ChemSpider 2D Image | N-(1-Azepanylcarbamoyl)-4-(~2~H_3_)methyl(~2~H_4_)benzenesulfonamide | C14H14D7N3O3S

N-(1-Azepanylcarbamoyl)-4-(2H3)methyl(2H4)benzenesulfonamide

  • Molecular FormulaC14H14D7N3O3S
  • Average mass318.443 Da
  • Monoisotopic mass318.174286 Da
  • ChemSpider ID48063486

  • Non-standard isotope - Non-standard isotope

More details:

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

Benzene-2,3,5,6-d4-sulfonamide, N-[[(hexahydro-1H-azepin-1-yl)amino]carbonyl]-4-(methyl-d3)- [ACD/Index Name]
N-(1-Azepanylcarbamoyl)-4-(2H3)methyl(2H4)benzenesulfonamide [ACD/IUPAC Name]
N-(1-Azépanylcarbamoyl)-4-(2H3)méthyl(2H4)benzènesulfonamide [French] [ACD/IUPAC Name]
N-(1-Azepanylcarbamoyl)-4-(2H3)methyl(2H4)benzolsulfonamid [German] [ACD/IUPAC Name]
1-(azepan-1-yl)-3-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]sulfonylurea
1794811-72-5 [RN]

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: 1.596
Molar Refractivity: 81.9±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.71
ACD/LogD (pH 5.5): 0.82
ACD/BCF (pH 5.5): 1.80
ACD/KOC (pH 5.5): 36.08
ACD/LogD (pH 7.4): -0.43
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.01
Polar Surface Area: 87 Å2
Polarizability: 32.5±0.5 10-24cm3
Surface Tension: 56.9±5.0 dyne/cm
Molar Volume: 240.6±5.0 cm3

Click to predict properties on the Chemicalize site


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