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Search term: JBIUFHDYJMTSIW-RPPIVITFSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | (2S)-2-Cyclohexyl-2-[2-(2,6-dimethoxy-3-pyridinyl)-5,6-difluoro-1H-benzimidazol-1-yl]-N-(trans-4-hydroxycyclohexyl)acetamide | C28H34F2N4O4

(2S)-2-Cyclohexyl-2-[2-(2,6-dimethoxy-3-pyridinyl)-5,6-difluoro-1H-benzimidazol-1-yl]-N-(trans-4-hydroxycyclohexyl)acetamide

  • Molecular FormulaC28H34F2N4O4
  • Average mass528.591 Da
  • Monoisotopic mass528.254822 Da
  • ChemSpider ID61711226

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(2S)-2-Cyclohexyl-2-[2-(2,6-dimethoxy-3-pyridinyl)-5,6-difluor-1H-benzimidazol-1-yl]-N-(trans-4-hydroxycyclohexyl)acetamid [German] [ACD/IUPAC Name]
(2S)-2-Cyclohexyl-2-[2-(2,6-dimethoxy-3-pyridinyl)-5,6-difluoro-1H-benzimidazol-1-yl]-N-(trans-4-hydroxycyclohexyl)acetamide [ACD/IUPAC Name]
(2S)-2-Cyclohexyl-2-[2-(2,6-diméthoxy-3-pyridinyl)-5,6-difluoro-1H-benzimidazol-1-yl]-N-(trans-4-hydroxycyclohexyl)acétamide [French] [ACD/IUPAC Name]
1H-Benzimidazole-1-acetamide, α-cyclohexyl-2-(2,6-dimethoxy-3-pyridinyl)-5,6-difluoro-N-(trans-4-hydroxycyclohexyl)-, (αS)- [ACD/Index Name]
(2s)-2-Cyclohexyl-2-[2-(2,6-Dimethoxypyridin-3-Yl)-5,6-Difluoro-1h-Benzimidazol-1-Yl]-N-(Trans-4-Hydroxycyclohexyl)acetamide
9NA

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: 1.641
Molar Refractivity: 135.8±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 5.60
ACD/LogD (pH 5.5): 4.51
ACD/BCF (pH 5.5): 1579.41
ACD/KOC (pH 5.5): 6777.65
ACD/LogD (pH 7.4): 4.51
ACD/BCF (pH 7.4): 1579.44
ACD/KOC (pH 7.4): 6777.77
Polar Surface Area: 99 Å2
Polarizability: 53.8±0.5 10-24cm3
Surface Tension: 47.7±7.0 dyne/cm
Molar Volume: 376.6±7.0 cm3

Click to predict properties on the Chemicalize site


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