ChemSpider 2D Image | N-(4-Chlorobenzyl)-N-[1-(cyclohexylamino)-1-oxo-2-butanyl]-4-[methyl(phenylsulfonyl)amino]butanamide | C28H38ClN3O4S

N-(4-Chlorobenzyl)-N-[1-(cyclohexylamino)-1-oxo-2-butanyl]-4-[methyl(phenylsulfonyl)amino]butanamide

  • Molecular FormulaC28H38ClN3O4S
  • Average mass548.137 Da
  • Monoisotopic mass547.227173 Da
  • ChemSpider ID68451325

More details:

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

Butanamide, N-[(4-chlorophenyl)methyl]-N-[1-[(cyclohexylamino)carbonyl]propyl]-4-[methyl(phenylsulfonyl)amino]- [ACD/Index Name]
N-(4-Chlorbenzyl)-N-[1-(cyclohexylamino)-1-oxo-2-butanyl]-4-[methyl(phenylsulfonyl)amino]butanamid [German] [ACD/IUPAC Name]
N-(4-Chlorobenzyl)-N-[1-(cyclohexylamino)-1-oxo-2-butanyl]-4-[methyl(phenylsulfonyl)amino]butanamide [ACD/IUPAC Name]
N-(4-Chlorobenzyl)-N-[1-(cyclohexylamino)-1-oxo-2-butanyl]-4-[méthyl(phénylsulfonyl)amino]butanamide [French] [ACD/IUPAC Name]
2-{N-[(4-CHLOROPHENYL)METHYL]-4-(N-METHYLBENZENESULFONAMIDO)BUTANAMIDO}-N-CYCLOHEXYLBUTANAMIDE

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: 148.8±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 5.41
ACD/LogD (pH 5.5): 4.60
ACD/BCF (pH 5.5): 1844.44
ACD/KOC (pH 5.5): 7573.60
ACD/LogD (pH 7.4): 4.60
ACD/BCF (pH 7.4): 1844.44
ACD/KOC (pH 7.4): 7573.60
Polar Surface Area: 95 Å2
Polarizability: 59.0±0.5 10-24cm3
Surface Tension: 55.8±5.0 dyne/cm
Molar Volume: 436.6±5.0 cm3

Click to predict properties on the Chemicalize site


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