ChemSpider 2D Image | Diphenylmethyl 2-{2-oxo-3-[(phenylacetyl)amino]-4-[(phenylsulfonyl)sulfanyl]-1-azetidinyl}-2,3-butadienoate | C34H28N2O6S2

Diphenylmethyl 2-{2-oxo-3-[(phenylacetyl)amino]-4-[(phenylsulfonyl)sulfanyl]-1-azetidinyl}-2,3-butadienoate

  • Molecular FormulaC34H28N2O6S2
  • Average mass624.726 Da
  • Monoisotopic mass624.138855 Da
  • ChemSpider ID8071044

More details:

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

1-Azetidineacetic acid, α-ethenylidene-2-oxo-3-[(2-phenylacetyl)amino]-4-[(phenylsulfonyl)thio]-, diphenylmethyl ester [ACD/Index Name]
2-{2-Oxo-3-[(2-phénylacétyl)amino]-4-[(phénylsulfonyl)sulfanyl]-1-azétidinyl}-2,3-butadiénoate de diphénylméthyle [French] [ACD/IUPAC Name]
Diphenylmethyl 2-{2-oxo-3-[(phenylacetyl)amino]-4-[(phenylsulfonyl)sulfanyl]-1-azetidinyl}-2,3-butadienoate [ACD/IUPAC Name]
Diphenylmethyl-2-{2-oxo-3-[(phenylacetyl)amino]-4-[(phenylsulfonyl)sulfanyl]-1-azetidinyl}-2,3-butadienoat [German] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.683
Molar Refractivity: 171.1±0.4 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 5.33
ACD/LogD (pH 5.5): 5.38
ACD/BCF (pH 5.5): 7245.61
ACD/KOC (pH 5.5): 20166.60
ACD/LogD (pH 7.4): 5.38
ACD/BCF (pH 7.4): 7245.59
ACD/KOC (pH 7.4): 20166.53
Polar Surface Area: 144 Å2
Polarizability: 67.8±0.5 10-24cm3
Surface Tension: 60.6±5.0 dyne/cm
Molar Volume: 451.4±5.0 cm3

Click to predict properties on the Chemicalize site


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