ChemSpider 2D Image | BMS 986020 | C29H26N2O5

BMS 986020

  • Molecular FormulaC29H26N2O5
  • Average mass482.527 Da
  • Monoisotopic mass482.184174 Da
  • ChemSpider ID57490377

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

1-{4'-[3-Methyl-4-({[(1R)-1-phenylethoxy]carbonyl}amino)-1,2-oxazol-5-yl]-4-biphenylyl}cyclopropancarbonsäure [German] [ACD/IUPAC Name]
1-{4'-[3-Methyl-4-({[(1R)-1-phenylethoxy]carbonyl}amino)-1,2-oxazol-5-yl]-4-biphenylyl}cyclopropanecarboxylic acid [ACD/IUPAC Name]
1257213-50-5 [RN]
Acide 1-{4'-[3-méthyl-4-({[(1R)-1-phényléthoxy]carbonyl}amino)-1,2-oxazol-5-yl]-4-biphénylyl}cyclopropanecarboxylique [French] [ACD/IUPAC Name]
BMS 986020
Cyclopropanecarboxylic acid, 1-[4'-[3-methyl-4-[[[(1R)-1-phenylethoxy]carbonyl]amino]-5-isoxazolyl][1,1'-biphenyl]-4-yl]- [ACD/Index Name]
(R)-1-(4'-(3-methyl-4-(((1-phenylethoxy)carbonyl)amino)isoxazol-5-yl)-[1,1'-biphenyl]-4-yl)cyclopropane-1-carboxylic acid
1-(4-{4-[3-methyl-4-({[(1R)-1-phenylethoxy]carbonyl}amino)-1,2-oxazol-5-yl]phenyl}phenyl)cyclopropane-1-carboxylic acid
1-[4'-[3-methyl-4-[[[(1R)-1-phenylethoxy]carbonyl]amino]-5-isoxazolyl][1,1'-biphenyl]-4-yl]-cyclopropanecarboxylic acid
1-{4'-[3-methyl-4-({[(1R)-1-phenylethoxy]carbonyl}amino)-1,2-oxazol-5-yl]-[1,1'-biphenyl]-4-yl}cyclopropane-1-carboxylic acid
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

38CTP01B4L [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 664.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 102.7±3.0 kJ/mol
Flash Point: 355.9±31.5 °C
Index of Refraction: 1.647
Molar Refractivity: 133.8±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.99
ACD/LogD (pH 5.5): 4.11
ACD/BCF (pH 5.5): 372.14
ACD/KOC (pH 5.5): 1002.67
ACD/LogD (pH 7.4): 2.34
ACD/BCF (pH 7.4): 6.33
ACD/KOC (pH 7.4): 17.06
Polar Surface Area: 102 Å2
Polarizability: 53.1±0.5 10-24cm3
Surface Tension: 61.1±3.0 dyne/cm
Molar Volume: 368.4±3.0 cm3

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