ChemSpider 2D Image | Nalpha-[(3-Chloro-4-methoxyphenyl)sulfonyl]-N-[4-(1-piperidinylsulfonyl)benzyl]phenylalaninamide | C28H32ClN3O6S2

Nα-[(3-Chloro-4-methoxyphenyl)sulfonyl]-N-[4-(1-piperidinylsulfonyl)benzyl]phenylalaninamide

  • Molecular FormulaC28H32ClN3O6S2
  • Average mass606.153 Da
  • Monoisotopic mass605.142090 Da
  • ChemSpider ID68486978

More details:

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

Benzenepropanamide, α-[[(3-chloro-4-methoxyphenyl)sulfonyl]amino]-N-[[4-(1-piperidinylsulfonyl)phenyl]methyl]- [ACD/Index Name]
Nα-[(3-Chlor-4-methoxyphenyl)sulfonyl]-N-[4-(1-piperidinylsulfonyl)benzyl]phenylalaninamid [German] [ACD/IUPAC Name]
Nα-[(3-Chloro-4-methoxyphenyl)sulfonyl]-N-[4-(1-piperidinylsulfonyl)benzyl]phenylalaninamide [ACD/IUPAC Name]
Nα-[(3-Chloro-4-méthoxyphényl)sulfonyl]-N-[4-(1-pipéridinylsulfonyl)benzyl]phénylalaninamide [French] [ACD/IUPAC Name]
2-(3-CHLORO-4-METHOXYBENZENESULFONAMIDO)-3-PHENYL-N-{[4-(PIPERIDINE-1-SULFONYL)PHENYL]METHYL}PROPANAMIDE

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.612
Molar Refractivity: 155.9±0.4 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 5.51
ACD/LogD (pH 5.5): 5.06
ACD/BCF (pH 5.5): 4149.29
ACD/KOC (pH 5.5): 13528.94
ACD/LogD (pH 7.4): 5.04
ACD/BCF (pH 7.4): 3961.29
ACD/KOC (pH 7.4): 12915.98
Polar Surface Area: 139 Å2
Polarizability: 61.8±0.5 10-24cm3
Surface Tension: 55.0±3.0 dyne/cm
Molar Volume: 448.6±3.0 cm3

Click to predict properties on the Chemicalize site


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