ChemSpider 2D Image | 1-[3-({4-[(4-Methylcyclohexyl)sulfamoyl]-2-nitrophenyl}amino)propyl]-3-piperidinecarboxamide | C22H35N5O5S

1-[3-({4-[(4-Methylcyclohexyl)sulfamoyl]-2-nitrophenyl}amino)propyl]-3-piperidinecarboxamide

  • Molecular FormulaC22H35N5O5S
  • Average mass481.609 Da
  • Monoisotopic mass481.235901 Da
  • ChemSpider ID31059940

More details:

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

1-[3-({4-[(4-Methylcyclohexyl)sulfamoyl]-2-nitrophenyl}amino)propyl]-3-piperidincarboxamid [German] [ACD/IUPAC Name]
1-[3-({4-[(4-Methylcyclohexyl)sulfamoyl]-2-nitrophenyl}amino)propyl]-3-piperidinecarboxamide [ACD/IUPAC Name]
1-[3-({4-[(4-Méthylcyclohexyl)sulfamoyl]-2-nitrophényl}amino)propyl]-3-pipéridinecarboxamide [French] [ACD/IUPAC Name]
3-Piperidinecarboxamide, 1-[3-[[4-[[(4-methylcyclohexyl)amino]sulfonyl]-2-nitrophenyl]amino]propyl]- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 709.2±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 103.7±3.0 kJ/mol
Flash Point: 382.7±35.7 °C
Index of Refraction: 1.604
Molar Refractivity: 126.5±0.4 cm3
#H bond acceptors: 10
#H bond donors: 4
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 4.20
ACD/LogD (pH 5.5): 0.60
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.97
ACD/LogD (pH 7.4): 2.24
ACD/BCF (pH 7.4): 16.71
ACD/KOC (pH 7.4): 131.24
Polar Surface Area: 159 Å2
Polarizability: 50.1±0.5 10-24cm3
Surface Tension: 62.3±5.0 dyne/cm
Molar Volume: 367.5±5.0 cm3

Click to predict properties on the Chemicalize site


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