ChemSpider 2D Image | N-[(1s,2r)-1-Benzyl-3-{(Cyclopropylmethyl)[(3-Methoxyphenyl)sulfonyl]amino}-2-Hydroxypropyl]-N'-Methylsuccinamide | C26H35N3O6S

N-[(1s,2r)-1-Benzyl-3-{(Cyclopropylmethyl)[(3-Methoxyphenyl)sulfonyl]amino}-2-Hydroxypropyl]-N'-Methylsuccinamide

  • Molecular FormulaC26H35N3O6S
  • Average mass517.638 Da
  • Monoisotopic mass517.224670 Da
  • ChemSpider ID13089435

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

Butanediamide, N1-[(1S,2R)-3-[(cyclopropylmethyl)[(3-methoxyphenyl)sulfonyl]amino]-2-hydroxy-1-(phenylmethyl)propyl]-N4-methyl- [ACD/Index Name]
N-[(1s,2r)-1-Benzyl-3-{(Cyclopropylmethyl)[(3-Methoxyphenyl)sulfonyl]amino}-2-Hydroxypropyl]-N'-Methylsuccinamide
N-[(2S,3R)-4-{(Cyclopropylmethyl)[(3-methoxyphenyl)sulfonyl]amino}-3-hydroxy-1-phenyl-2-butanyl]-N'-methylsuccinamid [German] [ACD/IUPAC Name]
N-[(2S,3R)-4-{(Cyclopropylmethyl)[(3-methoxyphenyl)sulfonyl]amino}-3-hydroxy-1-phenyl-2-butanyl]-N'-methylsuccinamide [ACD/IUPAC Name]
N-[(2S,3R)-4-{(Cyclopropylméthyl)[(3-méthoxyphényl)sulfonyl]amino}-3-hydroxy-1-phényl-2-butanyl]-N'-méthylsuccinamide [French] [ACD/IUPAC Name]
CARB-AD37
MUU

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: 1.585
Molar Refractivity: 137.7±0.4 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 1
ACD/LogP: 3.09
ACD/LogD (pH 5.5): 2.62
ACD/BCF (pH 5.5): 57.61
ACD/KOC (pH 5.5): 633.56
ACD/LogD (pH 7.4): 2.62
ACD/BCF (pH 7.4): 57.61
ACD/KOC (pH 7.4): 633.56
Polar Surface Area: 133 Å2
Polarizability: 54.6±0.5 10-24cm3
Surface Tension: 53.4±3.0 dyne/cm
Molar Volume: 411.1±3.0 cm3

Click to predict properties on the Chemicalize site


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