ChemSpider 2D Image | 2-(Methylamino)-N-(4-methyl-1,3-thiazol-2-yl)-5-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]benzamide | C15H16N6OS2

2-(Methylamino)-N-(4-methyl-1,3-thiazol-2-yl)-5-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]benzamide

  • Molecular FormulaC15H16N6OS2
  • Average mass360.457 Da
  • Monoisotopic mass360.082703 Da
  • ChemSpider ID23336229

More details:






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

2-(Methylamino)-N-(4-methyl-1,3-thiazol-2-yl)-5-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]benzamid [German] [ACD/IUPAC Name]
2-(Methylamino)-N-(4-methyl-1,3-thiazol-2-yl)-5-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]benzamide [ACD/IUPAC Name]
2-(Méthylamino)-N-(4-méthyl-1,3-thiazol-2-yl)-5-[(4-méthyl-4H-1,2,4-triazol-3-yl)sulfanyl]benzamide [French] [ACD/IUPAC Name]
Benzamide, 2-(methylamino)-N-(4-methyl-2-thiazolyl)-5-[(4-methyl-4H-1,2,4-triazol-3-yl)thio]- [ACD/Index Name]
5-(4-methyl-4H-1,2,4-triazol-3-ylthio)-2-(methylamino)-N-(4-methylthiazol-2-yl)benzamide
5-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methyl-1,3-thiazol-2-yl)-2-(methylamino)benzamide
CHEMBL490961
LOI
N-(4-methyl-1,3-thiazol-2-yl)-5-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-2-(methylamino)benzamide

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.737
Molar Refractivity: 99.2±0.5 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.45
ACD/LogD (pH 5.5): 2.57
ACD/BCF (pH 5.5): 53.02
ACD/KOC (pH 5.5): 595.08
ACD/LogD (pH 7.4): 2.33
ACD/BCF (pH 7.4): 30.51
ACD/KOC (pH 7.4): 342.43
Polar Surface Area: 138 Å2
Polarizability: 39.3±0.5 10-24cm3
Surface Tension: 59.3±7.0 dyne/cm
Molar Volume: 246.6±7.0 cm3

Click to predict properties on the Chemicalize site






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