Found 3747 results

Search term: MF = 'C_{27}H_{24}N_{2}O_{5}'
ChemSpider 2D Image | AM095 | C27H24N2O5

AM095

  • Molecular FormulaC27H24N2O5
  • Average mass456.490 Da
  • Monoisotopic mass456.168518 Da
  • ChemSpider ID28661897

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

[1,1'-Biphenyl]-4-acetic acid, 4'-[3-methyl-4-[[[(1R)-1-phenylethoxy]carbonyl]amino]-5-isoxazolyl]- [ACD/Index Name]
{4'-[3-methyl-4-({[(1R)-1-phenylethoxy]carbonyl}amino)-1,2-oxazol-5-yl]-[1,1'-biphenyl]-4-yl}acetic acid
{4'-[3-Methyl-4-({[(1R)-1-phenylethoxy]carbonyl}amino)-1,2-oxazol-5-yl]-4-biphenylyl}acetic acid [ACD/IUPAC Name]
{4'-[3-Methyl-4-({[(1R)-1-phenylethoxy]carbonyl}amino)-1,2-oxazol-5-yl]-4-biphenylyl}essigsäure [German] [ACD/IUPAC Name]
1228690-36-5 [RN]
2-{4'-[3-methyl-4-({[(1R)-1-phenylethoxy]carbonyl}amino)-1,2-oxazol-5-yl]-[1,1'-biphenyl]-4-yl}acetic acid
Acide {4'-[3-méthyl-4-({[(1R)-1-phényléthoxy]carbonyl}amino)-1,2-oxazol-5-yl]-4-biphénylyl}acétique [French] [ACD/IUPAC Name]
AM095
(R)-2-(4'-(3-Methyl-4-(((1-phenylethoxy)carbonyl)amino)isoxazol-5-yl)-[1,1'-biphenyl]-4-yl)acetic acid
(R)-2-(4'-(3-methyl-4-((1-phenylethoxy)carbonylamino)isoxazol-5-yl)biphenyl-4-yl)acetic acid
More...

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

PubChem Substance ID 329825761 [DBID]
  • Experimental Physico-chemical Properties
  • Miscellaneous

    • Bio Activity:

      AM095 is a potent LPA1 receptor antagonist with IC50 values of 0.98 and 0.73 ?M for recombinant human or mouse LPA1 respectively.; IC50 value: 0.98/0.73 uM (human/mouse LPA1); Target: LPA1 receptor; AM095 is an LPA1 receptor antagonist with good oral exposure and antifibrotic activity in rodent models. MedChem Express HY-16040
      GPCR/G protein MedChem Express HY-16040
      GPCR/G protein; MedChem Express HY-16040
      LPL Receptor MedChem Express HY-16040

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point: 641.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 99.6±3.0 kJ/mol
Flash Point: 342.0±31.5 °C
Index of Refraction: 1.629
Molar Refractivity: 126.9±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.94
ACD/LogD (pH 5.5): 3.88
ACD/BCF (pH 5.5): 253.66
ACD/KOC (pH 5.5): 774.60
ACD/LogD (pH 7.4): 2.11
ACD/BCF (pH 7.4): 4.27
ACD/KOC (pH 7.4): 13.04
Polar Surface Area: 102 Å2
Polarizability: 50.3±0.5 10-24cm3
Surface Tension: 54.9±3.0 dyne/cm
Molar Volume: 357.1±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement