Found 163 results

Search term: MF = 'C_{23}H_{27}N_{3}O_{8}S'
ChemSpider 2D Image | 2-[(2,3-Dihydro-1,4-benzodioxin-6-ylcarbamoyl)amino]-2-oxoethyl N-[(4-methylphenyl)sulfonyl]-L-valinate | C23H27N3O8S

2-[(2,3-Dihydro-1,4-benzodioxin-6-ylcarbamoyl)amino]-2-oxoethyl N-[(4-methylphenyl)sulfonyl]-L-valinate

  • Molecular FormulaC23H27N3O8S
  • Average mass505.541 Da
  • Monoisotopic mass505.151886 Da
  • ChemSpider ID10908954

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

2-[(2,3-Dihydro-1,4-benzodioxin-6-ylcarbamoyl)amino]-2-oxoethyl N-[(4-methylphenyl)sulfonyl]-L-valinate [ACD/IUPAC Name]
2-[(2,3-Dihydro-1,4-benzodioxin-6-ylcarbamoyl)amino]-2-oxoethyl-N-[(4-methylphenyl)sulfonyl]-L-valinat [German] [ACD/IUPAC Name]
L-Valine, N-[(4-methylphenyl)sulfonyl]-, 2-[[[(2,3-dihydro-1,4-benzodioxin-6-yl)amino]carbonyl]amino]-2-oxoethyl ester [ACD/Index Name]
N-[(4-Méthylphényl)sulfonyl]-L-valinate de 2-[(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)amino]-2-oxoéthyle [French] [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: 1.591
Molar Refractivity: 125.6±0.4 cm3
#H bond acceptors: 11
#H bond donors: 3
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 4.63
ACD/LogD (pH 5.5): 3.53
ACD/BCF (pH 5.5): 282.18
ACD/KOC (pH 5.5): 1974.79
ACD/LogD (pH 7.4): 3.48
ACD/BCF (pH 7.4): 253.64
ACD/KOC (pH 7.4): 1775.05
Polar Surface Area: 158 Å2
Polarizability: 49.8±0.5 10-24cm3
Surface Tension: 56.6±3.0 dyne/cm
Molar Volume: 371.9±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement