ChemSpider 2D Image | N-(6-{[(1,1-Dioxido-1,2-thiazolidin-3-yl)carbonyl]amino}hexanoyl)-beta-alanine | C13H23N3O6S

N-(6-{[(1,1-Dioxido-1,2-thiazolidin-3-yl)carbonyl]amino}hexanoyl)-β-alanine

  • Molecular FormulaC13H23N3O6S
  • Average mass349.403 Da
  • Monoisotopic mass349.130768 Da
  • ChemSpider ID81152934

More details:

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

N-(6-{[(1,1-Dioxido-1,2-thiazolidin-3-yl)carbonyl]amino}hexanoyl)-β-alanin [German] [ACD/IUPAC Name]
N-(6-{[(1,1-Dioxido-1,2-thiazolidin-3-yl)carbonyl]amino}hexanoyl)-β-alanine [ACD/IUPAC Name]
N-(6-{[(1,1-Dioxydo-1,2-thiazolidin-3-yl)carbonyl]amino}hexanoyl)-β-alanine [French] [ACD/IUPAC Name]
β-Alanine, N-[6-[[(1,1-dioxido-3-isothiazolidinyl)carbonyl]amino]-1-oxohexyl]- [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: 1.532
Molar Refractivity: 81.8±0.4 cm3
#H bond acceptors: 9
#H bond donors: 4
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: -3.16
ACD/LogD (pH 5.5): -3.24
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.01
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 150 Å2
Polarizability: 32.4±0.5 10-24cm3
Surface Tension: 54.1±3.0 dyne/cm
Molar Volume: 264.0±3.0 cm3

Click to predict properties on the Chemicalize site


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