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Search term: URGAGGFDWSHABX-RRPNLBNLSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | (2S)-N,2-Dicyclohexyl-2-{5,6-difluoro-2-[(R)-methoxy(phenyl)methyl]-1H-benzimidazol-1-yl}acetamide | C29H35F2N3O2

(2S)-N,2-Dicyclohexyl-2-{5,6-difluoro-2-[(R)-methoxy(phenyl)methyl]-1H-benzimidazol-1-yl}acetamide

  • Molecular FormulaC29H35F2N3O2
  • Average mass495.604 Da
  • Monoisotopic mass495.269745 Da
  • ChemSpider ID61711232

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2S)-N,2-Dicyclohexyl-2-{5,6-difluor-2-[(R)-methoxy(phenyl)methyl]-1H-benzimidazol-1-yl}acetamid [German] [ACD/IUPAC Name]
(2S)-N,2-Dicyclohexyl-2-{5,6-difluoro-2-[(R)-methoxy(phenyl)methyl]-1H-benzimidazol-1-yl}acetamide [ACD/IUPAC Name]
(2S)-N,2-Dicyclohexyl-2-{5,6-difluoro-2-[(R)-méthoxy(phényl)méthyl]-1H-benzimidazol-1-yl}acétamide [French] [ACD/IUPAC Name]
1H-Benzimidazole-1-acetamide, N,α-dicyclohexyl-5,6-difluoro-2-[(R)-methoxyphenylmethyl]-, (αS)- [ACD/Index Name]
9MP

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

Density: 1.3±0.1 g/cm3
Boiling Point: 675.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 99.2±3.0 kJ/mol
Flash Point: 362.2±31.5 °C
Index of Refraction: 1.620
Molar Refractivity: 135.3±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 7.65
ACD/LogD (pH 5.5): 6.74
ACD/BCF (pH 5.5): 78067.86
ACD/KOC (pH 5.5): 110534.19
ACD/LogD (pH 7.4): 6.74
ACD/BCF (pH 7.4): 78139.80
ACD/KOC (pH 7.4): 110636.05
Polar Surface Area: 56 Å2
Polarizability: 53.6±0.5 10-24cm3
Surface Tension: 43.9±7.0 dyne/cm
Molar Volume: 385.2±7.0 cm3

Click to predict properties on the Chemicalize site


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