ChemSpider 2D Image | N-(4-sec-Butylphenyl)-N-{1-(2,3-dimethoxyphenyl)-2-[(2-methyl-2-butanyl)amino]-2-oxoethyl}-N'-(5-methyl-1,2-oxazol-3-yl)succinamide | C33H44N4O6

N-(4-sec-Butylphenyl)-N-{1-(2,3-dimethoxyphenyl)-2-[(2-methyl-2-butanyl)amino]-2-oxoethyl}-N'-(5-methyl-1,2-oxazol-3-yl)succinamide

  • Molecular FormulaC33H44N4O6
  • Average mass592.726 Da
  • Monoisotopic mass592.326111 Da
  • ChemSpider ID2467254

More details:

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

Butanediamide, N1-[1-(2,3-dimethoxyphenyl)-2-[(1,1-dimethylpropyl)amino]-2-oxoethyl]-N4-(5-methyl-3-isoxazolyl)-N1-[4-(1-methylpropyl)phenyl]- [ACD/Index Name]
N-(4-sec-Butylphenyl)-N-{1-(2,3-dimethoxyphenyl)-2-[(2-methyl-2-butanyl)amino]-2-oxoethyl}-N'-(5-methyl-1,2-oxazol-3-yl)succinamid [German] [ACD/IUPAC Name]
N-(4-sec-Butylphenyl)-N-{1-(2,3-dimethoxyphenyl)-2-[(2-methyl-2-butanyl)amino]-2-oxoethyl}-N'-(5-methyl-1,2-oxazol-3-yl)succinamide [ACD/IUPAC Name]
N-(4-sec-Butylphényl)-N-{1-(2,3-diméthoxyphényl)-2-[(2-méthyl-2-butanyl)amino]-2-oxoéthyl}-N'-(5-méthyl-1,2-oxazol-3-yl)succinamide [French] [ACD/IUPAC Name]

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

ASN 05991299 [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: 804.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 117.0±3.0 kJ/mol
Flash Point: 440.6±34.3 °C
Index of Refraction: 1.571
Molar Refractivity: 167.0±0.3 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 2
ACD/LogP: 4.02
ACD/LogD (pH 5.5): 3.90
ACD/BCF (pH 5.5): 537.88
ACD/KOC (pH 5.5): 3134.90
ACD/LogD (pH 7.4): 3.90
ACD/BCF (pH 7.4): 537.88
ACD/KOC (pH 7.4): 3134.90
Polar Surface Area: 123 Å2
Polarizability: 66.2±0.5 10-24cm3
Surface Tension: 46.1±3.0 dyne/cm
Molar Volume: 508.4±3.0 cm3

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