ChemSpider 2D Image | 2-(1H-Benzotriazol-1-yl)-N-(2,3-dihydro-1H-inden-5-yl)-N-{1-(3-methoxyphenyl)-2-[(2-methyl-2-butanyl)amino]-2-oxoethyl}acetamide | C31H35N5O3

2-(1H-Benzotriazol-1-yl)-N-(2,3-dihydro-1H-inden-5-yl)-N-{1-(3-methoxyphenyl)-2-[(2-methyl-2-butanyl)amino]-2-oxoethyl}acetamide

  • Molecular FormulaC31H35N5O3
  • Average mass525.641 Da
  • Monoisotopic mass525.273987 Da
  • ChemSpider ID2447360

More details:

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

1H-1,2,3-Benzotriazole-1-acetamide, N-(2,3-dihydro-1H-inden-5-yl)-N-[2-[(1,1-dimethylpropyl)amino]-1-(3-methoxyphenyl)-2-oxoethyl]- [ACD/Index Name]
2-(1H-Benzotriazol-1-yl)-N-(2,3-dihydro-1H-inden-5-yl)-N-{1-(3-methoxyphenyl)-2-[(2-methyl-2-butanyl)amino]-2-oxoethyl}acetamid [German] [ACD/IUPAC Name]
2-(1H-Benzotriazol-1-yl)-N-(2,3-dihydro-1H-inden-5-yl)-N-{1-(3-methoxyphenyl)-2-[(2-methyl-2-butanyl)amino]-2-oxoethyl}acetamide [ACD/IUPAC Name]
2-(1H-Benzotriazol-1-yl)-N-(2,3-dihydro-1H-indén-5-yl)-N-{1-(3-méthoxyphényl)-2-[(2-méthyl-2-butanyl)amino]-2-oxoéthyl}acétamide [French] [ACD/IUPAC Name]

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

ASN 05255043 [DBID]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 768.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 111.9±3.0 kJ/mol
Flash Point: 418.4±32.9 °C
Index of Refraction: 1.634
Molar Refractivity: 152.6±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 5.69
ACD/LogD (pH 5.5): 4.54
ACD/BCF (pH 5.5): 1654.09
ACD/KOC (pH 5.5): 7005.47
ACD/LogD (pH 7.4): 4.54
ACD/BCF (pH 7.4): 1654.18
ACD/KOC (pH 7.4): 7005.81
Polar Surface Area: 89 Å2
Polarizability: 60.5±0.5 10-24cm3
Surface Tension: 47.4±7.0 dyne/cm
Molar Volume: 427.0±7.0 cm3

Click to predict properties on the Chemicalize site


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