ChemSpider 2D Image | 4-{N-[(3,4-Dimethoxyphenyl)sulfonyl]-N-(4-methoxyphenyl)glycyl}-N-(2-phenylethyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide | C34H35N3O8S

4-{N-[(3,4-Dimethoxyphenyl)sulfonyl]-N-(4-methoxyphenyl)glycyl}-N-(2-phenylethyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide

  • Molecular FormulaC34H35N3O8S
  • Average mass645.722 Da
  • Monoisotopic mass645.214478 Da
  • ChemSpider ID80962496

More details:

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

2H-1,4-Benzoxazine-2-carboxamide, 4-[2-[[(3,4-dimethoxyphenyl)sulfonyl](4-methoxyphenyl)amino]acetyl]-3,4-dihydro-N-(2-phenylethyl)- [ACD/Index Name]
4-{N-[(3,4-Dimethoxyphenyl)sulfonyl]-N-(4-methoxyphenyl)glycyl}-N-(2-phenylethyl)-3,4-dihydro-2H-1,4-benzoxazin-2-carboxamid [German] [ACD/IUPAC Name]
4-{N-[(3,4-Dimethoxyphenyl)sulfonyl]-N-(4-methoxyphenyl)glycyl}-N-(2-phenylethyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide [ACD/IUPAC Name]
4-{N-[(3,4-Diméthoxyphényl)sulfonyl]-N-(4-méthoxyphényl)glycyl}-N-(2-phényléthyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.620
Molar Refractivity: 172.5±0.4 cm3
#H bond acceptors: 11
#H bond donors: 1
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 4.14
ACD/LogD (pH 5.5): 4.11
ACD/BCF (pH 5.5): 781.31
ACD/KOC (pH 5.5): 4095.26
ACD/LogD (pH 7.4): 4.11
ACD/BCF (pH 7.4): 781.31
ACD/KOC (pH 7.4): 4095.28
Polar Surface Area: 132 Å2
Polarizability: 68.4±0.5 10-24cm3
Surface Tension: 55.4±3.0 dyne/cm
Molar Volume: 490.9±3.0 cm3

Click to predict properties on the Chemicalize site


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