ChemSpider 2D Image | BMX-IN-1 | C29H24N4O4S

BMX-IN-1

  • Molecular FormulaC29H24N4O4S
  • Average mass524.590 Da
  • Monoisotopic mass524.151855 Da
  • ChemSpider ID29211931

More details:






Validated by Experts, Validated by Users, Non-Validated, Removed by Users

2-Propenamide, N-[2-methyl-5-[9-[4-[(methylsulfonyl)amino]phenyl]-2-oxobenzo[h][1,6]naphthyridin-1(2H)-yl]phenyl]- [ACD/Index Name]
BMX-IN-1
N-{2-Methyl-5-[9-{4-[(methylsulfonyl)amino]phenyl}-2-oxobenzo[h][1,6]naphthyridin-1(2H)-yl]phenyl}acrylamid [German] [ACD/IUPAC Name]
N-{2-Methyl-5-[9-{4-[(methylsulfonyl)amino]phenyl}-2-oxobenzo[h][1,6]naphthyridin-1(2H)-yl]phenyl}acrylamide [ACD/IUPAC Name]
N-{2-Méthyl-5-[9-{4-[(méthylsulfonyl)amino]phényl}-2-oxobenzo[h][1,6]naphtyridin-1(2H)-yl]phényl}acrylamide [French] [ACD/IUPAC Name]
[1431525-23-3]
1431525-23-3 [RN]
BMX kinase inhibitor
BMX kinase inhibitor;N-(2-methyl-5-(9-(4-(methylsulfonamido)phenyl)-2-oxobenzo[h][1,6]naphthyridin-1(2H)-yl)phenyl)acrylamide
Example 1-14 [ WO2014063054]
More...
  • Experimental Physico-chemical Properties
  • Miscellaneous
    • Bio Activity:

      BMX Kinase MedChem Express HY-80002
      BMX-IN-1 is a highly selective and potent irreversible inhibitor which target the cysteine residue in the BMX ATP binding domain. MedChem Express
      BMX-IN-1 is a highly selective and potent irreversible inhibitor which target the cysteine residue in the BMX ATP binding domain.; IC50 Value: ; Target: BMX Kinase MedChem Express HY-80002
      BMX-IN-1 is a highly selective and potent irreversible inhibitor which target the cysteine residue in the BMX ATP binding domain.;IC50 Value: ;Target: BMX Kinase MedChem Express HY-80002
      Enzymes Tocris Bioscience 5123
      Kinases Tocris Bioscience 5123
      Other Kinases Tocris Bioscience 5123
      Potent and irreversible BMX inhibitor Tocris Bioscience 5123
      Potent and irreversible BMX inhibitor (IC50 = 25 nM). Covalently modifies Cysteine 496. Demonstrates selectivity over other Tec family members with identically positioned reactive cysteine residue in vitro. Reduces cell number and induces apoptosis in prostate cancer cell lines. Also inhibits proliferation and reduces viability in HeLa and SiHa cell lines. Tocris Bioscience 5123
      Protein Tyrosine Kinase/RTK MedChem Express HY-80002
      Protein Tyrosine Kinase/RTK; MedChem Express HY-80002

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.708
Molar Refractivity: 146.4±0.4 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 3.52
ACD/LogD (pH 5.5): 3.26
ACD/BCF (pH 5.5): 169.92
ACD/KOC (pH 5.5): 1302.32
ACD/LogD (pH 7.4): 3.17
ACD/BCF (pH 7.4): 135.78
ACD/KOC (pH 7.4): 1040.67
Polar Surface Area: 117 Å2
Polarizability: 58.0±0.5 10-24cm3
Surface Tension: 69.4±3.0 dyne/cm
Molar Volume: 375.4±3.0 cm3

Click to predict properties on the Chemicalize site






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