ChemSpider 2D Image | Isobutyl [(3-{4-[(2-ethyl-5,7-dimethyl-3H-imidazo[4,5-b]pyridin-3-yl)methyl]phenyl}-5-isobutyl-2-thienyl)sulfonyl]carbamate | C30H38N4O4S2

Isobutyl [(3-{4-[(2-ethyl-5,7-dimethyl-3H-imidazo[4,5-b]pyridin-3-yl)methyl]phenyl}-5-isobutyl-2-thienyl)sulfonyl]carbamate

  • Molecular FormulaC30H38N4O4S2
  • Average mass582.777 Da
  • Monoisotopic mass582.233459 Da
  • ChemSpider ID9664953

More details:

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

[(3-{4-[(2-Éthyl-5,7-diméthyl-3H-imidazo[4,5-b]pyridin-3-yl)méthyl]phényl}-5-isobutyl-2-thiényl)sulfonyl]carbamate d'isobutyle [French] [ACD/IUPAC Name]
2-methylpropyl {[3-{4-[(2-ethyl-5,7-dimethyl-3H-imidazo[4,5-b]pyridin-3-yl)methyl]phenyl}-5-(2-methylpropyl)thiophen-2-yl]sulfonyl}carbamate
Carbamic acid, N-[[3-[4-[(2-ethyl-5,7-dimethyl-3H-imidazo[4,5-b]pyridin-3-yl)methyl]phenyl]-5-(2-methylpropyl)-2-thienyl]sulfonyl]-, 2-methylpropyl ester [ACD/Index Name]
Isobutyl [(3-{4-[(2-ethyl-5,7-dimethyl-3H-imidazo[4,5-b]pyridin-3-yl)methyl]phenyl}-5-isobutyl-2-thienyl)sulfonyl]carbamate [ACD/IUPAC Name]
Isobutyl-[(3-{4-[(2-ethyl-5,7-dimethyl-3H-imidazo[4,5-b]pyridin-3-yl)methyl]phenyl}-5-isobutyl-2-thienyl)sulfonyl]carbamat [German] [ACD/IUPAC Name]
CHEMBL40563
N-Isobutyloxycarbonyl-3-[4-(2-ethyl-5,7-dimethylimidazo [4,5-b]pyridin-3-ylmethyl)phenyl]-5-isobutylthiophene-2-sulfonamide

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: 1.626
Molar Refractivity: 162.2±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 7.14
ACD/LogD (pH 5.5): 4.59
ACD/BCF (pH 5.5): 632.84
ACD/KOC (pH 5.5): 1024.15
ACD/LogD (pH 7.4): 4.48
ACD/BCF (pH 7.4): 501.85
ACD/KOC (pH 7.4): 812.17
Polar Surface Area: 140 Å2
Polarizability: 64.3±0.5 10-24cm3
Surface Tension: 45.5±7.0 dyne/cm
Molar Volume: 458.1±7.0 cm3

Click to predict properties on the Chemicalize site


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