ChemicalBook > CAS DataBase List > (3aR,6aR)-N-(4-((3-ethynylphenyl)amino)-7-methoxyquinazolin-6-yl)-1-methylhexahydropyrrolo[3,4-b]pyrrole-5(1H)-carboxamide

(3aR,6aR)-N-(4-((3-ethynylphenyl)amino)-7-methoxyquinazolin-6-yl)-1-methylhexahydropyrrolo[3,4-b]pyrrole-5(1H)-carboxamide

Product Name
(3aR,6aR)-N-(4-((3-ethynylphenyl)amino)-7-methoxyquinazolin-6-yl)-1-methylhexahydropyrrolo[3,4-b]pyrrole-5(1H)-carboxamide
CAS No.
1353644-70-8
Chemical Name
(3aR,6aR)-N-(4-((3-ethynylphenyl)amino)-7-methoxyquinazolin-6-yl)-1-methylhexahydropyrrolo[3,4-b]pyrrole-5(1H)-carboxamide
Synonyms
HMPL309;HMPL 309;HMPL-309;EOS-61583;Theliatinib;Theliatinib (HMPL-309);ThTheliatinib (HMPL-309);HMPL-309;HMPL 309;HMPL309;(3aR,6aR)-N-(4-((3-ethynylphenyl)amino)-7-methoxyquinazolin-6-yl)-1-methylhexahydropyrrolo[3,4-b]pyrrole-5(1H)-carboxamide;Pyrrolo[3,4-b]pyrrole-5(1H)-carboxamide, N-[4-[(3-ethynylphenyl)amino]-7-methoxy-6-quinazolinyl]hexahydro-1-methyl-, (3aR,6aR)-
CBNumber
CB23142246
Molecular Formula
C25H26N6O2
Formula Weight
442.51
MOL File
1353644-70-8.mol
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(3aR,6aR)-N-(4-((3-ethynylphenyl)amino)-7-methoxyquinazolin-6-yl)-1-methylhexahydropyrrolo[3,4-b]pyrrole-5(1H)-carboxamide Property

Boiling point:
675.6±55.0 °C(Predicted)
Density 
1.35±0.1 g/cm3(Predicted)
storage temp. 
Store at -20°C
solubility 
DMSO: 5 mg/mL (11.30 mM)
pka
13.59±0.20(Predicted)
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Hazard and Precautionary Statements (GHS)

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N-Bromosuccinimide Price

ChemScene
Product number
CS-0027986
Product name
Theliatinib
Purity
99.88%
Packaging
5mg
Price
$240
Updated
2021/12/16
ChemScene
Product number
CS-0027986
Product name
Theliatinib
Purity
99.88%
Packaging
10mg
Price
$390
Updated
2021/12/16
ChemScene
Product number
CS-0027986
Product name
Theliatinib
Purity
99.88%
Packaging
25mg
Price
$780
Updated
2021/12/16
ChemScene
Product number
CS-0027986
Product name
Theliatinib
Purity
99.88%
Packaging
50mg
Price
$1300
Updated
2021/12/16
ChemScene
Product number
CS-0027986
Product name
Theliatinib
Purity
99.88%
Packaging
100mg
Price
$2200
Updated
2021/12/16
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(3aR,6aR)-N-(4-((3-ethynylphenyl)amino)-7-methoxyquinazolin-6-yl)-1-methylhexahydropyrrolo[3,4-b]pyrrole-5(1H)-carboxamide Chemical Properties,Usage,Production

Biological Activity

Theliatinib (HMPL-309) is a potent EGFR inhibitor with a Ki value of 0.05 nM for EGFR and IC50 values of 3 nM and 22 nM for EGFR and EGFR T790M/L858R mutant, respectively. It is more than 50-fold selective for EGFR over 72 other kinases.

in vitro

Compared with erlotinib or gefitnib, theliatinib has stronger binding affinity to wild-type EGFR and is more difficult to be replaced by ATP, which makes theliatinib have better target binding effect, and the EGFR-activated tumors have stronger antitumor activity.

in vivo

Theliatinib has concentration-dependent antitumor activity in a series of patient-derived esophageal cancer xenograft models. But aberrant activation or genetic mutation of other targets such as PI3K and FGFR attenuates the antitumor activity of EGFR inhibitors, especially theliatinib.

target

< td style="border-bottom: 1px dotted #ccc;padding: 5px;"> 3 nM
TargetValue
WT EGFR
(Cell-free assay)
EGFR T790M/L858R
(Cell-free assay)		 22 nM

(3aR,6aR)-N-(4-((3-ethynylphenyl)amino)-7-methoxyquinazolin-6-yl)-1-methylhexahydropyrrolo[3,4-b]pyrrole-5(1H)-carboxamide Preparation Products And Raw materials

Raw materials

Preparation Products

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(3aR,6aR)-N-(4-((3-ethynylphenyl)amino)-7-methoxyquinazolin-6-yl)-1-methylhexahydropyrrolo[3,4-b]pyrrole-5(1H)-carboxamide Suppliers

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1353644-70-8, (3aR,6aR)-N-(4-((3-ethynylphenyl)amino)-7-methoxyquinazolin-6-yl)-1-methylhexahydropyrrolo[3,4-b]pyrrole-5(1H)-carboxamideRelated Search:

TG4-155 PH 797804 NVP-TAE684 Axitinib Lapatinib Dasatinib Erlotinib Sunitinib Ruxolitinib AZD-9291

  • EOS-61583
  • Theliatinib (HMPL-309)
  • (3aR,6aR)-N-(4-((3-ethynylphenyl)amino)-7-methoxyquinazolin-6-yl)-1-methylhexahydropyrrolo[3,4-b]pyrrole-5(1H)-carboxamide
  • ThTheliatinib (HMPL-309)
  • Theliatinib
  • HMPL 309
  • HMPL309
  • HMPL-309
  • HMPL-309;HMPL 309;HMPL309
  • ATP-competitive,inhibit,EGFR,ERK,cancer,esophageal,Epidermal growth factor receptor,HMPL-309,anti-tumor,Inhibitor,ErbB-1,HMPL309,Theliatinib,HER1,HMPL 309,orally,Xiliertinib,AKT,phosphorylation
  • Pyrrolo[3,4-b]pyrrole-5(1H)-carboxamide, N-[4-[(3-ethynylphenyl)amino]-7-methoxy-6-quinazolinyl]hexahydro-1-methyl-, (3aR,6aR)-
  • 1353644-70-8