ChemSpider 2D Image | N-[2-(1-Cyclohexen-1-yl)ethyl]-1-(4-methoxybenzyl)-2-methyl-5-[2-(6-methyl-3-pyridinyl)-1,3-thiazol-4-yl]-1H-pyrrole-3-carboxamide | C31H34N4O2S

N-[2-(1-Cyclohexen-1-yl)ethyl]-1-(4-methoxybenzyl)-2-methyl-5-[2-(6-methyl-3-pyridinyl)-1,3-thiazol-4-yl]-1H-pyrrole-3-carboxamide

  • Molecular FormulaC31H34N4O2S
  • Average mass526.692 Da
  • Monoisotopic mass526.240234 Da
  • ChemSpider ID3040765

More details:

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

1H-Pyrrole-3-carboxamide, N-[2-(1-cyclohexen-1-yl)ethyl]-1-[(4-methoxyphenyl)methyl]-2-methyl-5-[2-(6-methyl-3-pyridinyl)-4-thiazolyl]- [ACD/Index Name]
N-[2-(1-Cyclohexen-1-yl)ethyl]-1-(4-methoxybenzyl)-2-methyl-5-[2-(6-methyl-3-pyridinyl)-1,3-thiazol-4-yl]-1H-pyrrol-3-carboxamid [German] [ACD/IUPAC Name]
N-[2-(1-Cyclohexen-1-yl)ethyl]-1-(4-methoxybenzyl)-2-methyl-5-[2-(6-methyl-3-pyridinyl)-1,3-thiazol-4-yl]-1H-pyrrole-3-carboxamide [ACD/IUPAC Name]
N-[2-(1-Cyclohexén-1-yl)éthyl]-1-(4-méthoxybenzyl)-2-méthyl-5-[2-(6-méthyl-3-pyridinyl)-1,3-thiazol-4-yl]-1H-pyrrole-3-carboxamide [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.644
Molar Refractivity: 155.3±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 6.98
ACD/LogD (pH 5.5): 5.95
ACD/BCF (pH 5.5): 19376.44
ACD/KOC (pH 5.5): 40666.31
ACD/LogD (pH 7.4): 5.95
ACD/BCF (pH 7.4): 19560.58
ACD/KOC (pH 7.4): 41052.80
Polar Surface Area: 97 Å2
Polarizability: 61.6±0.5 10-24cm3
Surface Tension: 46.9±7.0 dyne/cm
Molar Volume: 428.9±7.0 cm3

Click to predict properties on the Chemicalize site


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