Indications and Usage Mechanisms of Action Clinical Research Binding Mode
ChemicalBook > CAS DataBase List > Selumetinib

Selumetinib

Indications and Usage Mechanisms of Action Clinical Research Binding Mode
Product Name
Selumetinib
CAS No.
606143-52-6
Chemical Name
Selumetinib
Synonyms
5-[(4-Bromo-2-chlorophenyl)amino]-4-fluoro-N-(2-hydroxyethoxy)-1-methyl-1H-benzimidazole-6-carboxamide;6-(4-bromo-2-chloroanilino)-7-fluoro-N-(2-hydroxyethoxy)-3-methylbenzimidazole-5-carboxamide;113183;CS-1912;AZD 6244;AZD-6224;umetinib;Smetinib;ARRY 142886;Selumetinib
CBNumber
CB81871940
Molecular Formula
C17H15BrClFN4O3
Formula Weight
457.68
MOL File
606143-52-6.mol
More
Less

Selumetinib Property

Melting point:
>219°C (dec.)
Density 
1.69
storage temp. 
-20°
solubility 
Soluble in DMSO (up to 50 mg/ml) or in Ethanol (up to 2 mg/ml)
form 
Beige powder.
pka
14.20±0.10(Predicted)
color 
White
Stability:
Stable for 1 year from date of purchase as supplied. Solutions in DMSO or ethanol may be stored at -20° for up to 2 months.
More
Less

Safety

HS Code 
29349990
More
Less

Hazard and Precautionary Statements (GHS)

Symbol(GHS)
Signal word
Danger
Hazard statements

H317May cause an allergic skin reaction

H318Causes serious eye damage

H373May cause damage to organs through prolonged or repeated exposure

Precautionary statements

P262Do not get in eyes, on skin, or on clothing.

P280Wear protective gloves/protective clothing/eye protection/face protection.

P312Call a POISON CENTER or doctor/physician if you feel unwell.

More
Less

N-Bromosuccinimide Price

Cayman Chemical
Product number
11599
Product name
AZD 6244
Purity
≥98%
Packaging
10mg
Price
$32
Updated
2024/03/01
Cayman Chemical
Product number
11599
Product name
AZD 6244
Purity
≥98%
Packaging
25mg
Price
$55
Updated
2024/03/01
Cayman Chemical
Product number
11599
Product name
AZD 6244
Purity
≥98%
Packaging
50mg
Price
$86
Updated
2024/03/01
Cayman Chemical
Product number
11599
Product name
AZD 6244
Purity
≥98%
Packaging
100mg
Price
$109
Updated
2024/03/01
Tocris
Product number
6815
Product name
Selumetinib
Purity
≥98%(HPLC)
Packaging
50
Price
$91
Updated
2021/12/16
More
Less

Selumetinib Chemical Properties,Usage,Production

Indications and Usage

Selumetinib, 1 has a chemical name of 5-[(4-Bromo-2-chlorophenyl)amino]-4-fluoro-N-(2-hydroxyethoxy)-1-methyl-1H-benzimidazole-6-carboxamide. It was developed by British company AstraZeneca and is used to treat advanced non-small cell lung cancer (NSCLC). It is mainly used to treat bile duct cancer, colon cancer, NSCLC, etc. Currently, Selumetinib is in stage III clinical trials for treatment of NSCLC.

Mechanisms of Action

Selumetinib is the first mitogenextracellular kinase (MEK1/2) inhibitor to be used in thyroid cancer clinical trials. It inhibits extracellular signal regulating kinase (ERK/2) and activates caspase to dramatically inhibit ERK1/2 phosphorylation.

Clinical Research

In phase II clinical trials of radioiodine-refractory papillary thyroid carcinoma, 39 patients took daily oral doses of Selumetinib (100mg bid) for 28 days; results showed that 21 patients’ conditions stabilized (54%), 11 patients’ conditions worsened (28%), 49% patients’ conditions were stable for 16 weeks, 36% patients’ conditions were stable for 24 weeks, and survival terms did not progress to 32 weeks. Negative reactions mainly consisted of rashes (59%), diarrhea (44%), and weakness (41%). Some studies found that after treating 20 patients with thyroid cancer with Selumetinib (75mg bid) for 4 weeks, Selumetinib increased the iodine uptake and retention of patients with radioiodine-refractory papillary thyroid carcinoma. In a blind and random comparative study between a Selumetinib and Docetaxel (DOC) combination treatment group and DOC and placebo treatment group for 87 mutant NSCLSC patients, survival times were 9.4 months and 5.2 months, PFS were 5.3 months and 2.1 months, RR were 37% and 0%, thus showing dramatic differences. Selumetinib’s main negative reactions include neutrophil depletion, dermatitis, and respiratory failure.

Binding Mode

In the co-crystal structure of selumetinib in complex with MEK1 and AMP–PNP (Fig. 3), selumetinib binds to a unique and specific allosteric pocket on the N-terminal domain of MEK1, next to a typical ATP-binding site. This binding results in a conformational change, which prevents the RAF-induced phosphorylation, and locks MEK1/2 into a catalytically inactive state, thereby blocking the RAS signaling. The imine nitrogen of the benzo[d]imidazole core hydrogen bonds to the amide NH of Ser212, and the three oxygen atoms of the amide side chain form three hydrogen bonds with the primary amine of Lys97. In addition, the terminal hydroxyl group hydrogen bonds to the α-phosphoryl oxygen of AMP–PNP (Fig. 4).

Description

Selumetinib (AZD6244; ARRY-142886) is an oral MEK inhibitor. In a randomized trial, NSCLC patients with wild-type KRAS were randomized to erlotinib alone or combination therapy with selumetinib, while mutant KRAS patients were randomized to selumetinib alone or combination therapy. The primary end points were PFS for the KRAS wild-type cohort and objective response rate (ORR) for the KRAS mutant cohort. Results were not impressive, with no PFS difference in the KRAS wild-type arm (2.4 vs. 2.1?months) and no ORR difference in the KRASmutated subgroup (0% vs. 10%). A planned trial of selumetinib in combination with the anti-PD-L1 antibody durvalumab has since been suspended (NCT03004105).

Uses

It is a tight-binding, uncompetitive inhibitor of mitogen-activated protein kinase kinases (MEK) 1 and 2 currently in clinical development. It is useful as biomarker in human lung cancer cell. Potent MEK inhibitor.

Definition

ChEBI: A member of the class of benzimidazoles that is 1-methyl-1H-benzimidazole which is substituted at positions 4, 5, and 6 by fluorine, (4-bromo-2-chlorophenyl)amino, and N-(2-hydroxyethoxy)aminocarbonyl groups, respectiv ly. It is a MEK1 and MEK2 inhibitor.

brand name

Koselugo

General Description

Class: dual threonine/tyrosine kinase; Treatment: children with NF1; Other name: AZD-6244, ARRY-142886; Oral bioavailability = 62%; Elimination half-life = 6.2 h; Protein binding = 97.7%

target

MEK1

Metabolism

Following oral administration of radiolabeled selumetinib, the most prominent drug-related component in the plasma was selumetinib, accounting for 40% of the plasma radioactivity. The major circulating metabolite was an amide glucuronide 2, which accounted for 22% of the plasma radioactivity. This metabolite resulted from loss of the ethanediol moiety to give the primary amide 1, which underwent glucuronidation and an additional loss of 2 mass units, most likely due to further oxidation of the N-methylbenzimidazole moiety (Fig. 5).

storage

Store at -20°C

Dosage

Selumetinib is characterized by a moderate oral bioavailability (62%) and a relatively short half-life (6.2 h), and these properties contribute to twice-daily dosing regimen (25 mg dosage).

References

1) Davies?et al. (2007),?AZD6244(ARRY-142886), a potent inhibitor of mitogen-activated protein kinase/extracellular signal-regulated kinase kinase 1/2 kinases: mechanism of action in vivo, pharmacokinetic/pharmacodynamics relationship, and potential for combination in preclinical models; Mol. Cancer Ther.,?6?2209 2) Yeh?et al. (2007),?Biological characterization of ARRY-142886 (AZD6244), a potent, highly selective mitogen-activated protein kinase kinase 1/2 inhibitor; Clin. Cancer Res.,?13?1576 3) Catalanotti?et al. (2013),?Phase II trial of MEK inhibitor selumetinib(AZD6244) in patients with BRAFV600E/K-mutated melanoma; Clin. Cancer Res.,?19?2257 4) O’Neil?et al. (2011),?Phase II study of the mitogen-activated protein kinase 1/2 inhibitor selumetinib in patients with advanced hepatocellular carcinoma; J. Clin. Oncol.,?29?2350 5) Khurum?et al. (2012),?A phase I dose escalation study of oral MK-2206 (allosteric Akt inhibitor) with oral selumetinib (AZD6244)(MEK 1/2 inhibitor) in patients with advanced or metastatic solid tumors; J. Clin. Oncol.,?30?e13599 6) Hainsworth?et al. (2010),?A phase II, open label, randomized study to assess the efficacy and safety of AZD6244 versus pemetrexed in patients with non-small cell lung cancer who have failed one or two prior chemotherapeutic regimens; J. Thorac. Oncol.,?5?1630 7) Bodoky?et al. (2012),?A phase II open-label randomized study to assess the efficacy and safety of selumetinib (AZD6244) versus capecitabine in patients with advanced or metastatic pancreatic cancer who have failed first-line gemcitabine therapy; Invest. New Drugs,?30?1216

Selumetinib Preparation Products And Raw materials

Raw materials

Preparation Products

More
Less

Selumetinib Suppliers

Hubei Junxian Biotechnology Co., Ltd
Tel
18908622922
Email
3464928989@qq.com
Country
China
ProdList
46
Advantage
58
WuYan Pharmaceutical Technology (Shanghai) Co., Ltd.
Tel
021-61001086 13671938079
Fax
021-61114075
Email
sales@wuyanpharm.com
Country
China
ProdList
104
Advantage
55
Shanghai Boyle Chemical Co., Ltd.
Tel
Fax
86-21-57758967
Email
sales@boylechem.com
Country
China
ProdList
2922
Advantage
55
J & K SCIENTIFIC LTD.
Tel
010-82848833 400-666-7788
Fax
86-10-82849933
Email
jkinfo@jkchemical.com
Country
China
ProdList
96815
Advantage
76
Chembest Research Laboratories Limited
Tel
+86-21-20908456
Fax
021-58180499
Email
sales@BioChemBest.com
Country
China
ProdList
6005
Advantage
61
Beijing HwrkChemical Technology Co., Ltd
Tel
010-89508211 18501085097
Fax
010-89508210
Email
sales.bj@hwrkchemical.com
Country
China
ProdList
8418
Advantage
55
JinYan Chemicals(ShangHai) Co.,Ltd.
Tel
13817811078
Fax
86-021-50426522,50426273
Email
sales@jingyan-chemical.com
Country
China
ProdList
9976
Advantage
60
Shanghai Paulshine Chemical Co., Ltd.
Tel
+86-021-37788663
Fax
+86-021-37788663
Country
China
ProdList
186
Advantage
64
Shanghai Hanhong Scientific Co.,Ltd.
Tel
021-54306202 13764082696
Email
info@hanhongsci.com
Country
China
ProdList
42958
Advantage
64
Chemsky (shanghai) International Co.,Ltd
Tel
021-50135380
Email
shchemsky@sina.com
Country
China
ProdList
15402
Advantage
60
More
Less

View Lastest Price from Selumetinib manufacturers

Cangzhou Kangrui Pharma Tech Co. Ltd.,
Product
Selumetinib 606143-52-6
Price
US $0.00-0.00/g
Min. Order
10g
Purity
99%
Supply Ability
1kg
Release date
2024-10-17
Zhengzhou Anbu Chem Co.,Ltd
Product
Selumetinib 606143-52-6
Price
US $0.00/KG
Min. Order
1KG
Purity
98%
Supply Ability
1000KGS
Release date
2023-06-19
Hebei Weibang Biotechnology Co., Ltd
Product
Selumetinib 606143-52-6
Price
US $10.00/KG
Min. Order
1KG
Purity
99%
Supply Ability
10 mt
Release date
2021-08-06

606143-52-6, SelumetinibRelated Search:


  • ARRY 142886
  • AZD 6244
  • 5-[(4-Bromo-2-chlorophenyl)amino]-4-fluoro-N-(2-hydroxyethoxy)-1-methyl-1H-benzimidazole-6-carboxamide
  • 6-(4-bromo-2-chloroanilino)-7-fluoro-N-(2-hydroxyethoxy)-3-methylbenzimidazole-5-carboxamide
  • Selumetinib AZD624
  • 5-[(4-Bromo-2-chlorophenyl)amino]-4-fluoro-N-(2-hydroxyethoxy)-1-methyl-1H-benzimidazole-6-car
  • Selumetinib, 99%, a highly selective MEK1 inhibitor
  • Selumetinib, Free BaseAZD6244ARRY-142886
  • Selumetinib (AZD6244) Selumetinib
  • ARRY-142886; SELUMETINIB;AZD-6244;ARRY142886
  • AZD6244 (ARRY142886, Selumetinib)
  • AZD6244 (Selumetinib,ARRY-142886)
  • 113183
  • CS-1912
  • Selumetinib Base
  • Selumetinib
  • 5-(4-Bromo-2-chlorophenylamino)-4-fluoro-N-(2-hydroxyethoxy)-1-methyl-1H-benzo[d]imidazole-6-carboxamide
  • 6-(4-Bromo-2-chlorophenylamino)-7-fluoro-N-(2-hydroxyethoxy)-3-methyl-3H-benzo[d]imidazole-5-carboxamide
  • SeluMatinib(5-[(4-BroMo-2-chlorophenyl)aMino]-4-fluoro-N-(2-hydroxyethoxy)-1-Methyl-1H-benziMidazole-6-carboxaMide
  • AZD6244(SeluMetinib)
  • AZD6244; ARRY142886
  • SeluMetinib (AZD6244)
  • Array142886
  • AZD-6244(SeluMetinib)/AZD6244
  • 5-[(4-Bromo-2-chlorophenyl)amino]-4-fluoro-N-(2-hydroxyethoxy)-1-methyl-1H-benzimidazole-6-carbox
  • AZD6244, ARRY-142886, ARRY-886
  • 5-(4-BroMo-2-chlorophenylaMino)-4-fluoro-1-Methyl-1H-benziMidazole-6-carbohydroxaMic acid 2-hydroxyethyl ester
  • 5-[(4-Bromo-2-chlorophenyl)amino]-4-fluoro-N-(2-hydroxyethoxy)-1-methyl-1H-benzimidazole-6-carboxamide Selumetinib (AZD6244)
  • AZD 6244 5-[(4-Bromo-2-chlorophenyl)amino]-4-fluoro-N-(2-hydroxyethoxy)-1-methyl-1H-benzimidazole-6-carboxamide
  • selumetinib (MEK inhibitor)
  • Selumetinib, >=98%
  • AZD-6224
  • umetinib
  • umetinib (AZD6244) SeL
  • 1H-Benzimidazole-6-carboxamide, 5-[(4-bromo-2-chlorophenyl)amino]-4-fluoro-N-(2-hydroxyethoxy)-1-methyl-
  • Selumetinib USP/EP/BP
  • Selumetinib D4
  • 5-((4-Bromo-2-chlorophenyl)amino)-4-fluoro-N-(2-hydroxyethoxy)-1-methyl-1H-benzodimidazol-6-carboxamide
  • Selumetinib API
  • Smetinib
  • Quinoxyfen Impurity 1
  • 606143-52-6
  • 60614-52-6
  • C17H15BrClFN4O3
  • MAPK
  • Inhibitors
  • Antineoplastic
  • apis
  • Aromatics
  • Heterocycles
  • Inhibitor
  • Intermediates & Fine Chemicals
  • Pharmaceuticals
  • API
  • Research