ChemSpider 2D Image | 6'-[(Ethylcarbamoyl)amino]-4'-[4-(trifluoromethyl)-1,3-thiazol-2-yl]-3,3'-bipyridine-5-carboxylic acid | C18H14F3N5O3S

6'-[(Ethylcarbamoyl)amino]-4'-[4-(trifluoromethyl)-1,3-thiazol-2-yl]-3,3'-bipyridine-5-carboxylic acid

  • Molecular FormulaC18H14F3N5O3S
  • Average mass437.396 Da
  • Monoisotopic mass437.076935 Da
  • ChemSpider ID34239851

More details:

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

[3,3'-Bipyridine]-5-carboxylic acid, 6'-[[(ethylamino)carbonyl]amino]-4'-[4-(trifluoromethyl)-2-thiazolyl]- [ACD/Index Name]
6'-[(Ethylcarbamoyl)amino]-4'-[4-(trifluormethyl)-1,3-thiazol-2-yl]-3,3'-bipyridin-5-carbonsäure [German] [ACD/IUPAC Name]
6'-[(Ethylcarbamoyl)amino]-4'-[4-(trifluoromethyl)-1,3-thiazol-2-yl]-3,3'-bipyridine-5-carboxylic acid [ACD/IUPAC Name]
Acide 6'-[(éthylcarbamoyl)amino]-4'-[4-(trifluorométhyl)-1,3-thiazol-2-yl]-3,3'-bipyridine-5-carboxylique [French] [ACD/IUPAC Name]
1YM

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: 1.615
Molar Refractivity: 102.5±0.3 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.69
ACD/LogD (pH 5.5): 0.44
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.80
ACD/LogD (pH 7.4): -0.40
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 145 Å2
Polarizability: 40.6±0.5 10-24cm3
Surface Tension: 58.0±3.0 dyne/cm
Molar Volume: 293.6±3.0 cm3

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