ChemicalBook > CAS DataBase List > (2S,3R)-3-(3,4-DIFLUOROPHENYL)-2-(4-FLUOROPHENYL)-4-HYDROXY-N-((3S)-2-OXO-5-PHENYL-2,3-1H-BENZO[E][1,4]DIAZEPIN-3-YL)BUTYRAMIDE

(2S,3R)-3-(3,4-DIFLUOROPHENYL)-2-(4-FLUOROPHENYL)-4-HYDROXY-N-((3S)-2-OXO-5-PHENYL-2,3-1H-BENZO[E][1,4]DIAZEPIN-3-YL)BUTYRAMIDE

Product Name
(2S,3R)-3-(3,4-DIFLUOROPHENYL)-2-(4-FLUOROPHENYL)-4-HYDROXY-N-((3S)-2-OXO-5-PHENYL-2,3-1H-BENZO[E][1,4]DIAZEPIN-3-YL)BUTYRAMIDE
CAS No.
2081093-21-0
Chemical Name
(2S,3R)-3-(3,4-DIFLUOROPHENYL)-2-(4-FLUOROPHENYL)-4-HYDROXY-N-((3S)-2-OXO-5-PHENYL-2,3-1H-BENZO[E][1,4]DIAZEPIN-3-YL)BUTYRAMIDE
Synonyms
COMPOUND 34;CHMFL-ABL/KIT-155;GAMMA-SECRETASE INHIBITOR XIX;CHMFL-ABL/KIT-155 (CHMFL-ABL-KIT-155;CHMFL-ABL/KIT-155 (CHMFL-ABL-KIT-155; COMPOUND 34);(2S,3R)-3-(3,4-DIFLUOROPHENYL)-2-(4-FLUOROPHENYL)-4-HYDROXY-N-((3S)-2-OXO-5-PHENYL-2,3-1H-BENZO[E][1,4]DIAZEPIN-3-YL)BUTYRAMIDE;(2S,3R)-3-(3,4-DIFLUOROPHENYL)-2-(4-FLUOROPHENYL)-4-HYDROXY-N-((3S)-2-OXO-5-PHENYL-2,3-DIHYDRO-1H-BENZO[E][1,4]DIAZEPIN-3-YL)-BUTYRAMIDE;Benzamide, N-[4-methyl-3-[[1-[(6-methyl-3-pyridinyl)carbonyl]-4-piperidinyl]oxy]phenyl]-4-[(4-methyl-1-piperazinyl)methyl]-3-(trifluoromethyl)-
CBNumber
CB9806092
Molecular Formula
C33H38F3N5O3
Formula Weight
609.68
MOL File
Mol file
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(2S,3R)-3-(3,4-DIFLUOROPHENYL)-2-(4-FLUOROPHENYL)-4-HYDROXY-N-((3S)-2-OXO-5-PHENYL-2,3-1H-BENZO[E][1,4]DIAZEPIN-3-YL)BUTYRAMIDE Property

Boiling point:
660.5±55.0 °C(Predicted)
Density 
1.271±0.06 g/cm3(Predicted)
storage temp. 
Store at -20°C
solubility 
Soluble in DMSO
pka
12.67±0.70(Predicted)
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Hazard and Precautionary Statements (GHS)

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N-Bromosuccinimide Price

Usbiological
Product number
044678
Product name
Compound 34
Packaging
200ug
Price
$312
Updated
2021/12/16
American Custom Chemicals Corporation
Product number
INB0009791
Product name
COMPOUND 34
Purity
95.00%
Packaging
5MG
Price
$515
Updated
2021/12/16
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(2S,3R)-3-(3,4-DIFLUOROPHENYL)-2-(4-FLUOROPHENYL)-4-HYDROXY-N-((3S)-2-OXO-5-PHENYL-2,3-1H-BENZO[E][1,4]DIAZEPIN-3-YL)BUTYRAMIDE Chemical Properties,Usage,Production

Description

CHMFL-ABL/KIT-155 (CHMFL-ABL-KIT-155; compound 34) is a highly potent and orally active type II ABL/c-KIT dual kinase inhibitor (IC50s of 46 nM and 75 nM, respectively), and it also presents significant inhibitory activities to BLK (IC50=81 nM), CSF1R (IC50=227 nM), DDR1 (IC50=116 nM), DDR2 (IC50=325 nM), LCK (IC50=12 nM) and PDGFRβ (IC50=80 nM) kinases. CHMFL-ABL/KIT-155 (CHMFL-ABL-KIT-155) arrests cell cycle progression and induces apoptosis[1]. IC50: 46 nM (type II ABL), 75 nM (c-KIT), 81 nM (BLK), 227 nM (CSF1R), 116 nM (DDR1), 325 nM (DDR2), 12 nM (LCK), 80 nM (PDGFRβ)[1]

CHMFL-ABL/KIT-155 (CHMFL-ABL-KIT-155) exhibits anti-proliferation activities in the BCR-ABL dependent CML cancer cell lines such as K562 (GI50: 0.027 µM), MEG-01 (GI50: 0.02 µM), and KU812 (GI50: 0.056 µM). It also potently inhibits the growth of c-KIT dependent GISTs cancer cell lines including GIST-T1 (GI50: 0.023 µM), GIST-882 (GI50: 0.095 µM) but not c-KIT independent GIST-48B (GI50: 3.96 µM) [1].

CHMFL-ABL/KIT-155 (CHMFL-ABL-KIT-155) (25-100 mg/kg; p.o.; once daily for 28 days) shows dose-dependent tumor progression suppression without apparent toxicity in female nu/nu mice bearing established K562 tumor xenografts[1].

References

[1]. Wang Q, et al. Discovery of 4-Methyl-N-(4-((4-methylpiperazin-1-yl)methyl)-3-(trifluoromethyl)phenyl)-3-((1-nicotinoylpiperidin-4-yl)oxy)benzamide (CHMFL-ABL/KIT-155) as a Novel Highly Potent Type II ABL/KIT Dual Kinase Inhibitor with a Distinct Hinge Binding. J Med Chem. 2017 Jan 12;60(1):273-289.

(2S,3R)-3-(3,4-DIFLUOROPHENYL)-2-(4-FLUOROPHENYL)-4-HYDROXY-N-((3S)-2-OXO-5-PHENYL-2,3-1H-BENZO[E][1,4]DIAZEPIN-3-YL)BUTYRAMIDE Preparation Products And Raw materials

Raw materials

Preparation Products

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(2S,3R)-3-(3,4-DIFLUOROPHENYL)-2-(4-FLUOROPHENYL)-4-HYDROXY-N-((3S)-2-OXO-5-PHENYL-2,3-1H-BENZO[E][1,4]DIAZEPIN-3-YL)BUTYRAMIDE Suppliers

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2081093-21-0, (2S,3R)-3-(3,4-DIFLUOROPHENYL)-2-(4-FLUOROPHENYL)-4-HYDROXY-N-((3S)-2-OXO-5-PHENYL-2,3-1H-BENZO[E][1,4]DIAZEPIN-3-YL)BUTYRAMIDERelated Search:

GAMMA-SECRETASE INHIBITOR

  • (2S,3R)-3-(3,4-DIFLUOROPHENYL)-2-(4-FLUOROPHENYL)-4-HYDROXY-N-((3S)-2-OXO-5-PHENYL-2,3-1H-BENZO[E][1,4]DIAZEPIN-3-YL)BUTYRAMIDE
  • (2S,3R)-3-(3,4-DIFLUOROPHENYL)-2-(4-FLUOROPHENYL)-4-HYDROXY-N-((3S)-2-OXO-5-PHENYL-2,3-DIHYDRO-1H-BENZO[E][1,4]DIAZEPIN-3-YL)-BUTYRAMIDE
  • COMPOUND 34
  • GAMMA-SECRETASE INHIBITOR XIX
  • CHMFL-ABL/KIT-155
  • CHMFL-ABL/KIT-155 (CHMFL-ABL-KIT-155
  • CHMFL-ABL/KIT-155 (CHMFL-ABL-KIT-155; COMPOUND 34)
  • Benzamide, N-[4-methyl-3-[[1-[(6-methyl-3-pyridinyl)carbonyl]-4-piperidinyl]oxy]phenyl]-4-[(4-methyl-1-piperazinyl)methyl]-3-(trifluoromethyl)-
  • 2081093-21-0