ChemSpider 2D Image | Ethyl 1-ethyl-4-({3-[(2-methoxy-5-methylphenyl)carbamoyl]-1-piperidinyl}sulfonyl)-2,5-dimethyl-1H-pyrrole-3-carboxylate | C25H35N3O6S

Ethyl 1-ethyl-4-({3-[(2-methoxy-5-methylphenyl)carbamoyl]-1-piperidinyl}sulfonyl)-2,5-dimethyl-1H-pyrrole-3-carboxylate

  • Molecular FormulaC25H35N3O6S
  • Average mass505.627 Da
  • Monoisotopic mass505.224670 Da
  • ChemSpider ID20440404

More details:

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

1-Éthyl-4-({3-[(2-méthoxy-5-méthylphényl)carbamoyl]-1-pipéridinyl}sulfonyl)-2,5-diméthyl-1H-pyrrole-3-carboxylate d'éthyle [French] [ACD/IUPAC Name]
1H-Pyrrole-3-carboxylic acid, 1-ethyl-4-[[3-[[(2-methoxy-5-methylphenyl)amino]carbonyl]-1-piperidinyl]sulfonyl]-2,5-dimethyl-, ethyl ester [ACD/Index Name]
Ethyl 1-ethyl-4-({3-[(2-methoxy-5-methylphenyl)carbamoyl]-1-piperidinyl}sulfonyl)-2,5-dimethyl-1H-pyrrole-3-carboxylate [ACD/IUPAC Name]
Ethyl-1-ethyl-4-({3-[(2-methoxy-5-methylphenyl)carbamoyl]-1-piperidinyl}sulfonyl)-2,5-dimethyl-1H-pyrrol-3-carboxylat [German] [ACD/IUPAC Name]
ethyl 1-ethyl-4-[(3-{[(2-methoxy-5-methylphenyl)amino]carbonyl}piperidin-1-yl)sulfonyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate

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: 1.590
Molar Refractivity: 134.2±0.5 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 4.24
ACD/LogD (pH 5.5): 4.36
ACD/BCF (pH 5.5): 1215.60
ACD/KOC (pH 5.5): 5619.20
ACD/LogD (pH 7.4): 4.36
ACD/BCF (pH 7.4): 1215.78
ACD/KOC (pH 7.4): 5620.01
Polar Surface Area: 115 Å2
Polarizability: 53.2±0.5 10-24cm3
Surface Tension: 44.7±7.0 dyne/cm
Molar Volume: 397.9±7.0 cm3

Click to predict properties on the Chemicalize site


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