ChemSpider 2D Image | N-(3-Acetylphenyl)-2-(1H-benzotriazol-1-yl)-N-[2-(cyclohexylamino)-1-(4-ethoxyphenyl)-2-oxoethyl]acetamide | C32H35N5O4

N-(3-Acetylphenyl)-2-(1H-benzotriazol-1-yl)-N-[2-(cyclohexylamino)-1-(4-ethoxyphenyl)-2-oxoethyl]acetamide

  • Molecular FormulaC32H35N5O4
  • Average mass553.651 Da
  • Monoisotopic mass553.268921 Da
  • ChemSpider ID2432893

More details:

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

1H-1,2,3-Benzotriazole-1-acetamide, N-(3-acetylphenyl)-N-[2-(cyclohexylamino)-1-(4-ethoxyphenyl)-2-oxoethyl]- [ACD/Index Name]
N-(3-Acetylphenyl)-2-(1H-benzotriazol-1-yl)-N-[2-(cyclohexylamino)-1-(4-ethoxyphenyl)-2-oxoethyl]acetamid [German] [ACD/IUPAC Name]
N-(3-Acetylphenyl)-2-(1H-benzotriazol-1-yl)-N-[2-(cyclohexylamino)-1-(4-ethoxyphenyl)-2-oxoethyl]acetamide [ACD/IUPAC Name]
N-(3-Acétylphényl)-2-(1H-benzotriazol-1-yl)-N-[2-(cyclohexylamino)-1-(4-éthoxyphényl)-2-oxoéthyl]acétamide [French] [ACD/IUPAC Name]

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

ASN 04059670 [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 813.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 118.3±3.0 kJ/mol
Flash Point: 445.8±34.3 °C
Index of Refraction: 1.643
Molar Refractivity: 157.9±0.5 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 4.95
ACD/LogD (pH 5.5): 3.95
ACD/BCF (pH 5.5): 588.03
ACD/KOC (pH 5.5): 3341.43
ACD/LogD (pH 7.4): 3.95
ACD/BCF (pH 7.4): 588.05
ACD/KOC (pH 7.4): 3341.57
Polar Surface Area: 106 Å2
Polarizability: 62.6±0.5 10-24cm3
Surface Tension: 50.6±7.0 dyne/cm
Molar Volume: 436.6±7.0 cm3

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