ChemSpider 2D Image | N-{2-[(2-{[2-(Methylsulfanyl)-3-pyridinyl]carbonyl}hydrazino)carbonyl]phenyl}-2-thiophenesulfonamide | C18H16N4O4S3

N-{2-[(2-{[2-(Methylsulfanyl)-3-pyridinyl]carbonyl}hydrazino)carbonyl]phenyl}-2-thiophenesulfonamide

  • Molecular FormulaC18H16N4O4S3
  • Average mass448.539 Da
  • Monoisotopic mass448.033356 Da
  • ChemSpider ID31055113

More details:

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

3-Pyridinecarboxylic acid, 2-(methylthio)-, 2-[2-[(2-thienylsulfonyl)amino]benzoyl]hydrazide [ACD/Index Name]
N-{2-[(2-{[2-(Methylsulfanyl)-3-pyridinyl]carbonyl}hydrazino)carbonyl]phenyl}-2-thiophenesulfonamide [ACD/IUPAC Name]
N-{2-[(2-{[2-(Méthylsulfanyl)-3-pyridinyl]carbonyl}hydrazino)carbonyl]phényl}-2-thiophènesulfonamide [French] [ACD/IUPAC Name]
N-{2-[(2-{[2-(Methylsulfanyl)-3-pyridinyl]carbonyl}hydrazino)carbonyl]phenyl}-2-thiophensulfonamid [German] [ACD/IUPAC Name]
1197479-88-1 [RN]
N-(2-{N'-[2-(methylsulfanyl)pyridine-3-carbonyl]hydrazinecarbonyl}phenyl)thiophene-2-sulfonamide
N-(2-{N`-[2-(METHYLSULFANYL)PYRIDINE-3-CARBONYL]HYDRAZINECARBONYL}PHENYL)THIOPHENE-2-SULFONAMIDE

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.713
Molar Refractivity: 114.0±0.4 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.40
ACD/LogD (pH 5.5): 2.36
ACD/BCF (pH 5.5): 35.80
ACD/KOC (pH 5.5): 439.02
ACD/LogD (pH 7.4): 1.48
ACD/BCF (pH 7.4): 4.76
ACD/KOC (pH 7.4): 58.38
Polar Surface Area: 179 Å2
Polarizability: 45.2±0.5 10-24cm3
Surface Tension: 82.1±5.0 dyne/cm
Molar Volume: 290.9±5.0 cm3

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