ChemSpider 2D Image | N-{(R)-1H-Indol-3-yl[4-(4-methoxybenzyl)-5-(2-phenylethyl)-4H-1,2,4-triazol-3-yl]methyl}-2-(2-pyridinyl)acetamide | C34H32N6O2

N-{(R)-1H-Indol-3-yl[4-(4-methoxybenzyl)-5-(2-phenylethyl)-4H-1,2,4-triazol-3-yl]methyl}-2-(2-pyridinyl)acetamide

  • Molecular FormulaC34H32N6O2
  • Average mass556.657 Da
  • Monoisotopic mass556.258667 Da
  • ChemSpider ID23311429

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

2-Pyridineacetamide, N-[(R)-1H-indol-3-yl[4-[(4-methoxyphenyl)methyl]-5-(2-phenylethyl)-4H-1,2,4-triazol-3-yl]methyl]- [ACD/Index Name]
N-{(R)-1H-Indol-3-yl[4-(4-methoxybenzyl)-5-(2-phenylethyl)-4H-1,2,4-triazol-3-yl]methyl}-2-(2-pyridinyl)acetamid [German] [ACD/IUPAC Name]
N-{(R)-1H-Indol-3-yl[4-(4-methoxybenzyl)-5-(2-phenylethyl)-4H-1,2,4-triazol-3-yl]methyl}-2-(2-pyridinyl)acetamide [ACD/IUPAC Name]
N-{(R)-1H-Indol-3-yl[4-(4-méthoxybenzyl)-5-(2-phényléthyl)-4H-1,2,4-triazol-3-yl]méthyl}-2-(2-pyridinyl)acétamide [French] [ACD/IUPAC Name]
N-{(R)-1H-indol-3-yl[4-(4-methoxybenzyl)-5-(2-phenylethyl)-4H-1,2,4-triazol-3-yl]methyl}-2-(pyridin-2-yl)acetamide
(R)-N-((4-(4-methoxybenzyl)-5-phenethyl-4H-1,2,4-triazol-3-yl)(1H-indol-3-yl)methyl)-2-(pyridin-2-yl)acetamide
CHEMBL399648

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.665
Molar Refractivity: 165.2±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 4.96
ACD/LogD (pH 5.5): 4.65
ACD/BCF (pH 5.5): 1981.94
ACD/KOC (pH 5.5): 7845.38
ACD/LogD (pH 7.4): 4.67
ACD/BCF (pH 7.4): 2096.72
ACD/KOC (pH 7.4): 8299.75
Polar Surface Area: 98 Å2
Polarizability: 65.5±0.5 10-24cm3
Surface Tension: 50.9±7.0 dyne/cm
Molar Volume: 445.1±7.0 cm3

Click to predict properties on the Chemicalize site


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