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Search term: JBLFHKBJHMUDCM-VWLOTQADSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | (2S)-2-[2-(4-Chlorophenyl)-5,6-difluoro-1H-benzimidazol-1-yl]-2-cyclohexyl-N-(2-fluorophenyl)acetamide | C27H23ClF3N3O

(2S)-2-[2-(4-Chlorophenyl)-5,6-difluoro-1H-benzimidazol-1-yl]-2-cyclohexyl-N-(2-fluorophenyl)acetamide

  • Molecular FormulaC27H23ClF3N3O
  • Average mass497.939 Da
  • Monoisotopic mass497.148163 Da
  • ChemSpider ID61711237

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-2-[2-(4-Chlorophenyl)-5,6-difluoro-1H-benzimidazol-1-yl]-2-cyclohexyl-N-(2-fluorophenyl)acetamide [ACD/IUPAC Name]
(2S)-2-[2-(4-Chlorophényl)-5,6-difluoro-1H-benzimidazol-1-yl]-2-cyclohexyl-N-(2-fluorophényl)acétamide [French] [ACD/IUPAC Name]
(2S)-2-[2-(4-Chlorphenyl)-5,6-difluor-1H-benzimidazol-1-yl]-2-cyclohexyl-N-(2-fluorphenyl)acetamid [German] [ACD/IUPAC Name]
1H-Benzimidazole-1-acetamide, 2-(4-chlorophenyl)-α-cyclohexyl-5,6-difluoro-N-(2-fluorophenyl)-, (αS)- [ACD/Index Name]
9LS

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.639
Molar Refractivity: 129.4±0.5 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 7.89
ACD/LogD (pH 5.5): 6.84
ACD/BCF (pH 5.5): 92805.18
ACD/KOC (pH 5.5): 125117.26
ACD/LogD (pH 7.4): 6.84
ACD/BCF (pH 7.4): 92841.97
ACD/KOC (pH 7.4): 125166.86
Polar Surface Area: 47 Å2
Polarizability: 51.3±0.5 10-24cm3
Surface Tension: 45.0±7.0 dyne/cm
Molar Volume: 359.7±7.0 cm3

Click to predict properties on the Chemicalize site


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