ChemSpider 2D Image | 1-{[5-(5-Chloro-2-thienyl)-1,2-oxazol-3-yl]methyl}-2-[(1-cyclopropyl-4-piperidinyl)carbamoyl]-1H-benzimidazole-5-carboxylic acid | C25H24ClN5O4S

1-{[5-(5-Chloro-2-thienyl)-1,2-oxazol-3-yl]methyl}-2-[(1-cyclopropyl-4-piperidinyl)carbamoyl]-1H-benzimidazole-5-carboxylic acid

  • Molecular FormulaC25H24ClN5O4S
  • Average mass526.007 Da
  • Monoisotopic mass525.123779 Da
  • ChemSpider ID34248535

More details:

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

1-{[5-(5-Chlor-2-thienyl)-1,2-oxazol-3-yl]methyl}-2-[(1-cyclopropyl-4-piperidinyl)carbamoyl]-1H-benzimidazol-5-carbonsäure [German] [ACD/IUPAC Name]
1-{[5-(5-Chloro-2-thienyl)-1,2-oxazol-3-yl]methyl}-2-[(1-cyclopropyl-4-piperidinyl)carbamoyl]-1H-benzimidazole-5-carboxylic acid [ACD/IUPAC Name]
1H-Benzimidazole-5-carboxylic acid, 1-[[5-(5-chloro-2-thienyl)-3-isoxazolyl]methyl]-2-[[(1-cyclopropyl-4-piperidinyl)amino]carbonyl]- [ACD/Index Name]
Acide 1-{[5-(5-chloro-2-thiényl)-1,2-oxazol-3-yl]méthyl}-2-[(1-cyclopropyl-4-pipéridinyl)carbamoyl]-1H-benzimidazole-5-carboxylique [French] [ACD/IUPAC Name]
1-{[5-(5-chlorothiophen-2-yl)-1,2-oxazol-3-yl]methyl}-2-[(1-cyclopropylpiperidin-4-yl)carbamoyl]-1H-benzimidazole-5-carboxylic acid
NOCAS_47384

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.789
Molar Refractivity: 135.9±0.5 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 4.18
ACD/LogD (pH 5.5): 1.43
ACD/BCF (pH 5.5): 1.80
ACD/KOC (pH 5.5): 10.30
ACD/LogD (pH 7.4): 1.43
ACD/BCF (pH 7.4): 1.80
ACD/KOC (pH 7.4): 10.31
Polar Surface Area: 142 Å2
Polarizability: 53.9±0.5 10-24cm3
Surface Tension: 71.1±7.0 dyne/cm
Molar Volume: 321.3±7.0 cm3

Click to predict properties on the Chemicalize site


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