ChemSpider 2D Image | 3-Chloro-N-[(1S,2R)-2-{[4-(2-oxo-1(2H)-pyridinyl)benzoyl]amino}cyclohexyl]-1H-indole-6-carboxamide | C27H25ClN4O3

3-Chloro-N-[(1S,2R)-2-{[4-(2-oxo-1(2H)-pyridinyl)benzoyl]amino}cyclohexyl]-1H-indole-6-carboxamide

  • Molecular FormulaC27H25ClN4O3
  • Average mass488.965 Da
  • Monoisotopic mass488.161530 Da
  • ChemSpider ID23294744

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

1H-Indole-6-carboxamide, 3-chloro-N-[(1S,2R)-2-[[4-(2-oxo-1(2H)-pyridinyl)benzoyl]amino]cyclohexyl]- [ACD/Index Name]
3-Chlor-N-[(1S,2R)-2-{[4-(2-oxo-1(2H)-pyridinyl)benzoyl]amino}cyclohexyl]-1H-indol-6-carboxamid [German] [ACD/IUPAC Name]
3-Chloro-N-[(1S,2R)-2-{[4-(2-oxo-1(2H)-pyridinyl)benzoyl]amino}cyclohexyl]-1H-indole-6-carboxamide [ACD/IUPAC Name]
3-Chloro-N-[(1S,2R)-2-{[4-(2-oxo-1(2H)-pyridinyl)benzoyl]amino}cyclohexyl]-1H-indole-6-carboxamide [French] [ACD/IUPAC Name]
3-chloro-N-[(1S,2R)-2-{[4-(2-oxopyridin-1(2H)-yl)benzoyl]amino}cyclohexyl]-1H-indole-6-carboxamide
3-chloro-N-((1S,2R)-2-(4-(2-oxopyridin-1(2H)-yl)benzamido)cyclohexyl)-1H-indole-6-carboxamide
CHEMBL233984
cis-(±)-3-chloro-N-(-2-(4-(2-oxopyridin-1(2H)-yl)benzamido)cyclohexyl)-1H-indole-6-carboxamide

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

Density: 1.4±0.1 g/cm3
Boiling Point: 846.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.2 mmHg at 25°C
Enthalpy of Vaporization: 123.0±3.0 kJ/mol
Flash Point: 465.7±34.3 °C
Index of Refraction: 1.706
Molar Refractivity: 135.2±0.4 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.46
ACD/LogD (pH 5.5): 2.69
ACD/BCF (pH 5.5): 65.50
ACD/KOC (pH 5.5): 694.50
ACD/LogD (pH 7.4): 2.69
ACD/BCF (pH 7.4): 65.50
ACD/KOC (pH 7.4): 694.50
Polar Surface Area: 94 Å2
Polarizability: 53.6±0.5 10-24cm3
Surface Tension: 71.6±5.0 dyne/cm
Molar Volume: 347.4±5.0 cm3

Click to predict properties on the Chemicalize site


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