ChemSpider 2D Image | 2-{[5-Chloro-2-(1H-1,2,4-triazol-1-yl)phenyl]amino}-2-oxoethyl 1H-indazole-3-carboxylate | C18H13ClN6O3

2-{[5-Chloro-2-(1H-1,2,4-triazol-1-yl)phenyl]amino}-2-oxoethyl 1H-indazole-3-carboxylate

  • Molecular FormulaC18H13ClN6O3
  • Average mass396.787 Da
  • Monoisotopic mass396.073761 Da
  • ChemSpider ID22382271

More details:

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

1H-Indazole-3-carboxylate de 2-{[5-chloro-2-(1H-1,2,4-triazol-1-yl)phényl]amino}-2-oxoéthyle [French] [ACD/IUPAC Name]
1H-Indazole-3-carboxylic acid, 2-[[5-chloro-2-(1H-1,2,4-triazol-1-yl)phenyl]amino]-2-oxoethyl ester [ACD/Index Name]
2-{[5-Chlor-2-(1H-1,2,4-triazol-1-yl)phenyl]amino}-2-oxoethyl-1H-indazol-3-carboxylat [German] [ACD/IUPAC Name]
2-{[5-Chloro-2-(1H-1,2,4-triazol-1-yl)phenyl]amino}-2-oxoethyl 1H-indazole-3-carboxylate [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.742
Molar Refractivity: 102.2±0.5 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.43
ACD/LogD (pH 5.5): 2.15
ACD/BCF (pH 5.5): 25.41
ACD/KOC (pH 5.5): 352.58
ACD/LogD (pH 7.4): 2.15
ACD/BCF (pH 7.4): 25.40
ACD/KOC (pH 7.4): 352.54
Polar Surface Area: 115 Å2
Polarizability: 40.5±0.5 10-24cm3
Surface Tension: 66.6±7.0 dyne/cm
Molar Volume: 252.9±7.0 cm3

Click to predict properties on the Chemicalize site


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