ChemSpider 2D Image | 1-[(1-Isopropyl-1H-benzotriazol-5-yl)sulfonyl]-N-[3-(2-oxo-1-pyrrolidinyl)propyl]-3-piperidinecarboxamide | C22H32N6O4S

1-[(1-Isopropyl-1H-benzotriazol-5-yl)sulfonyl]-N-[3-(2-oxo-1-pyrrolidinyl)propyl]-3-piperidinecarboxamide

  • Molecular FormulaC22H32N6O4S
  • Average mass476.592 Da
  • Monoisotopic mass476.220581 Da
  • ChemSpider ID28973197

More details:

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

1-[(1-Isopropyl-1H-benzotriazol-5-yl)sulfonyl]-N-[3-(2-oxo-1-pyrrolidinyl)propyl]-3-piperidincarboxamid [German] [ACD/IUPAC Name]
1-[(1-Isopropyl-1H-benzotriazol-5-yl)sulfonyl]-N-[3-(2-oxo-1-pyrrolidinyl)propyl]-3-piperidinecarboxamide [ACD/IUPAC Name]
1-[(1-Isopropyl-1H-benzotriazol-5-yl)sulfonyl]-N-[3-(2-oxo-1-pyrrolidinyl)propyl]-3-pipéridinecarboxamide [French] [ACD/IUPAC Name]
3-Piperidinecarboxamide, 1-[[1-(1-methylethyl)-1H-1,2,3-benzotriazol-5-yl]sulfonyl]-N-[3-(2-oxo-1-pyrrolidinyl)propyl]- [ACD/Index Name]

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: 1.683
Molar Refractivity: 125.9±0.5 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 0.42
ACD/LogD (pH 5.5): 0.77
ACD/BCF (pH 5.5): 2.28
ACD/KOC (pH 5.5): 62.86
ACD/LogD (pH 7.4): 0.77
ACD/BCF (pH 7.4): 2.28
ACD/KOC (pH 7.4): 62.86
Polar Surface Area: 126 Å2
Polarizability: 49.9±0.5 10-24cm3
Surface Tension: 59.9±7.0 dyne/cm
Molar Volume: 332.0±7.0 cm3

Click to predict properties on the Chemicalize site


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