ChemSpider 2D Image | 1,3-Thiazol-5-ylmethyl {4-[{[2-(dimethylamino)-1,3-benzoxazol-6-yl]sulfonyl}(isobutyl)amino]-3-hydroxy-1-phenyl-2-butanyl}carbamate | C28H35N5O6S2

1,3-Thiazol-5-ylmethyl {4-[{[2-(dimethylamino)-1,3-benzoxazol-6-yl]sulfonyl}(isobutyl)amino]-3-hydroxy-1-phenyl-2-butanyl}carbamate

  • Molecular FormulaC28H35N5O6S2
  • Average mass601.737 Da
  • Monoisotopic mass601.202881 Da
  • ChemSpider ID9436959

More details:

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

{4-[{[2-(Diméthylamino)-1,3-benzoxazol-6-yl]sulfonyl}(isobutyl)amino]-3-hydroxy-1-phényl-2-butanyl}carbamate de 1,3-thiazol-5-ylméthyle [French] [ACD/IUPAC Name]
1,3-Thiazol-5-ylmethyl {4-[{[2-(dimethylamino)-1,3-benzoxazol-6-yl]sulfonyl}(isobutyl)amino]-3-hydroxy-1-phenyl-2-butanyl}carbamate [ACD/IUPAC Name]
1,3-Thiazol-5-ylmethyl-{4-[{[2-(dimethylamino)-1,3-benzoxazol-6-yl]sulfonyl}(isobutyl)amino]-3-hydroxy-1-phenyl-2-butanyl}carbamat [German] [ACD/IUPAC Name]
Carbamic acid, N-[3-[[[2-(dimethylamino)-6-benzoxazolyl]sulfonyl](2-methylpropyl)amino]-2-hydroxy-1-(phenylmethyl)propyl]-, 5-thiazolylmethyl ester [ACD/Index 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: 1.625
Molar Refractivity: 159.1±0.4 cm3
#H bond acceptors: 11
#H bond donors: 2
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 3
ACD/LogP: 5.06
ACD/LogD (pH 5.5): 4.10
ACD/BCF (pH 5.5): 768.90
ACD/KOC (pH 5.5): 4048.25
ACD/LogD (pH 7.4): 4.10
ACD/BCF (pH 7.4): 769.02
ACD/KOC (pH 7.4): 4048.87
Polar Surface Area: 175 Å2
Polarizability: 63.1±0.5 10-24cm3
Surface Tension: 62.0±3.0 dyne/cm
Molar Volume: 450.2±3.0 cm3

Click to predict properties on the Chemicalize site


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