ChemSpider 2D Image | N-(4-Isopropylphenyl)-N-(methylsulfonyl)glycyl-N~2~-(4-chlorobenzyl)-N-cyclohexylalaninamide | C28H38ClN3O4S

N-(4-Isopropylphenyl)-N-(methylsulfonyl)glycyl-N2-(4-chlorobenzyl)-N-cyclohexylalaninamide

  • Molecular FormulaC28H38ClN3O4S
  • Average mass548.137 Da
  • Monoisotopic mass547.227173 Da
  • ChemSpider ID68451323

More details:

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

Alaninamide, N-[4-(1-methylethyl)phenyl]-N-(methylsulfonyl)glycyl-N2-[(4-chlorophenyl)methyl]-N-cyclohexyl- [ACD/Index Name]
N-(4-Isopropylphenyl)-N-(methylsulfonyl)glycyl-N2-(4-chlorbenzyl)-N-cyclohexylalaninamid [German] [ACD/IUPAC Name]
N-(4-Isopropylphenyl)-N-(methylsulfonyl)glycyl-N2-(4-chlorobenzyl)-N-cyclohexylalaninamide [ACD/IUPAC Name]
N-(4-Isopropylphényl)-N-(méthylsulfonyl)glycyl-N2-(4-chlorobenzyl)-N-cyclohexylalaninamide [French] [ACD/IUPAC Name]
2-{N-[(4-CHLOROPHENYL)METHYL]-2-[N-(4-ISOPROPYLPHENYL)METHANESULFONAMIDO]ACETAMIDO}-N-CYCLOHEXYLPROPANAMIDE
2-{N-[(4-CHLOROPHENYL)METHYL]-2-{N-[4-(PROPAN-2-YL)PHENYL]METHANESULFONAMIDO}ACETAMIDO}-N-CYCLOHEXYLPROPANAMIDE

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.597
Molar Refractivity: 148.7±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 5.76
ACD/LogD (pH 5.5): 4.93
ACD/BCF (pH 5.5): 3273.75
ACD/KOC (pH 5.5): 11419.96
ACD/LogD (pH 7.4): 4.93
ACD/BCF (pH 7.4): 3273.75
ACD/KOC (pH 7.4): 11419.96
Polar Surface Area: 95 Å2
Polarizability: 59.0±0.5 10-24cm3
Surface Tension: 55.0±5.0 dyne/cm
Molar Volume: 436.7±5.0 cm3

Click to predict properties on the Chemicalize site


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