ChemSpider 2D Image | {[(4'-Methoxy-4-biphenylyl)sulfonyl]amino}{3-[methyl(methylsulfonyl)amino]cyclohexyl}acetic acid | C23H30N2O7S2

{[(4'-Methoxy-4-biphenylyl)sulfonyl]amino}{3-[methyl(methylsulfonyl)amino]cyclohexyl}acetic acid

  • Molecular FormulaC23H30N2O7S2
  • Average mass510.624 Da
  • Monoisotopic mass510.149445 Da
  • ChemSpider ID23153097

More details:

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

{[(4'-Methoxy-4-biphenylyl)sulfonyl]amino}{3-[methyl(methylsulfonyl)amino]cyclohexyl}acetic acid [ACD/IUPAC Name]
{[(4'-Methoxy-4-biphenylyl)sulfonyl]amino}{3-[methyl(methylsulfonyl)amino]cyclohexyl}essigsäure [German] [ACD/IUPAC Name]
{[(4'-methoxybiphenyl-4-yl)sulfonyl]amino}{3-[methyl(methylsulfonyl)amino]cyclohexyl}acetic acid
Acide {[(4'-méthoxy-4-biphénylyl)sulfonyl]amino}{3-[méthyl(méthylsulfonyl)amino]cyclohexyl}acétique [French] [ACD/IUPAC Name]
Cyclohexaneacetic acid, α-[[(4'-methoxy[1,1'-biphenyl]-4-yl)sulfonyl]amino]-3-[methyl(methylsulfonyl)amino]- [ACD/Index Name]
[3-(Methanesulfonyl-methyl-amino)-cyclohexyl]-(4'-methoxy-biphenyl-4-sulfonylamino)-acetic acid
CHEMBL305160

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

Density: 1.4±0.1 g/cm3
Boiling Point: 703.6±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 108.1±3.0 kJ/mol
Flash Point: 379.3±35.7 °C
Index of Refraction: 1.626
Molar Refractivity: 128.8±0.4 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 3.32
ACD/LogD (pH 5.5): 0.17
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.81
ACD/LogD (pH 7.4): -0.86
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 147 Å2
Polarizability: 51.1±0.5 10-24cm3
Surface Tension: 65.4±5.0 dyne/cm
Molar Volume: 364.1±5.0 cm3

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