ChemSpider 2D Image | N-(Adamantan-2-yl)-3-(2-amino-5-chloro-1H-benzimidazol-1-yl)pentanamide | C22H29ClN4O

N-(Adamantan-2-yl)-3-(2-amino-5-chloro-1H-benzimidazol-1-yl)pentanamide

  • Molecular FormulaC22H29ClN4O
  • Average mass400.945 Da
  • Monoisotopic mass400.203003 Da
  • ChemSpider ID26326769

  • defined stereocentres - 6 of 6 defined stereocentres

More details:

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

(3s)-3-(2-Amino-5-Chloro-1h-Benzimidazol-1-Yl)-N-[(1r,3s,5r,7r)-Tricyclo[3.3.1.13,7]dec-2-Yl]pentanamide
1H-Benzimidazole-1-propanamide, 2-amino-5-chloro-β-ethyl-N-tricyclo[3.3.1.13,7]dec-2-yl- [ACD/Index Name]
N-(Adamantan-2-yl)-3-(2-amino-5-chlor-1H-benzimidazol-1-yl)pentanamid [German] [ACD/IUPAC Name]
N-(Adamantan-2-yl)-3-(2-amino-5-chloro-1H-benzimidazol-1-yl)pentanamide [ACD/IUPAC Name]
N-(Adamantan-2-yl)-3-(2-amino-5-chloro-1H-benzimidazol-1-yl)pentanamide [French] [ACD/IUPAC Name]
EV6

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.748
Molar Refractivity: 108.4±0.5 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.86
ACD/LogD (pH 5.5): 4.02
ACD/BCF (pH 5.5): 508.44
ACD/KOC (pH 5.5): 2175.18
ACD/LogD (pH 7.4): 4.51
ACD/BCF (pH 7.4): 1554.36
ACD/KOC (pH 7.4): 6649.79
Polar Surface Area: 73 Å2
Polarizability: 43.0±0.5 10-24cm3
Surface Tension: 58.5±7.0 dyne/cm
Molar Volume: 266.7±7.0 cm3

Click to predict properties on the Chemicalize site


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