ChemSpider 2D Image | 2,2'-(2-Hydroxy-1,4-butanediyl)bis[N-(2-hydroxyethyl)-N-(2-phenyl-2-propanyl)benzamide] | C40H48N2O5

2,2'-(2-Hydroxy-1,4-butanediyl)bis[N-(2-hydroxyethyl)-N-(2-phenyl-2-propanyl)benzamide]

  • Molecular FormulaC40H48N2O5
  • Average mass636.820 Da
  • Monoisotopic mass636.356323 Da
  • ChemSpider ID405662

More details:

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

2,2'-(2-Hydroxy-1,4-butandiyl)bis[N-(2-hydroxyethyl)-N-(2-phenyl-2-propanyl)benzamid] [German] [ACD/IUPAC Name]
2,2'-(2-Hydroxy-1,4-butanediyl)bis[N-(2-hydroxyethyl)-N-(2-phenyl-2-propanyl)benzamide] [ACD/IUPAC Name]
2,2'-(2-Hydroxy-1,4-butanediyl)bis[N-(2-hydroxyéthyl)-N-(2-phényl-2-propanyl)benzamide] [French] [ACD/IUPAC Name]
2,2'-(2-hydroxybutane-1,4-diyl)bis[N-(2-hydroxyethyl)-N-(2-phenylpropan-2-yl)benzamide]
Benzamide, 2,2'-(2-hydroxy-1,4-butanediyl)bis[N-(2-hydroxyethyl)-N-(1-methyl-1-phenylethyl)- [ACD/Index Name]
1N-(2-hydroxyethyl)-1N-(1-methyl-1-phenylethyl)-2-(3-hydroxy-4-{2-[2-hydroxyethyl(1-methyl-1-phenylethyl)carbamoyl]phenyl}butyl)benzamide
AG1132 analog
N-tert-Butyl-N-(2-hydroxyethyl)-2-[3-hydroxy-4-[2-[(2-hydroxyethyl)(1-methyl-1-phenylethyl)carbamoyl]phenyl]butyll]benzamide

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

AIDS028309 [DBID]
AIDS-028309 [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: 833.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.2 mmHg at 25°C
Enthalpy of Vaporization: 126.9±3.0 kJ/mol
Flash Point: 457.6±34.3 °C
Index of Refraction: 1.606
Molar Refractivity: 186.8±0.3 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 1
ACD/LogP: 4.20
ACD/LogD (pH 5.5): 5.14
ACD/BCF (pH 5.5): 4718.07
ACD/KOC (pH 5.5): 14834.51
ACD/LogD (pH 7.4): 5.14
ACD/BCF (pH 7.4): 4718.07
ACD/KOC (pH 7.4): 14834.51
Polar Surface Area: 101 Å2
Polarizability: 74.1±0.5 10-24cm3
Surface Tension: 51.5±3.0 dyne/cm
Molar Volume: 541.6±3.0 cm3

Click to predict properties on the Chemicalize site


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