ChemSpider 2D Image | 3-(2,6-Dichlorophenyl)-5-methyl-N-[5-(phenoxymethyl)-1,3,4-thiadiazol-2-yl]-1,2-oxazole-4-carboxamide | C20H14Cl2N4O3S

3-(2,6-Dichlorophenyl)-5-methyl-N-[5-(phenoxymethyl)-1,3,4-thiadiazol-2-yl]-1,2-oxazole-4-carboxamide

  • Molecular FormulaC20H14Cl2N4O3S
  • Average mass461.321 Da
  • Monoisotopic mass460.016357 Da
  • ChemSpider ID21836698

More details:

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

3-(2,6-Dichlorophenyl)-5-methyl-N-[5-(phenoxymethyl)-1,3,4-thiadiazol-2-yl]-1,2-oxazole-4-carboxamide [ACD/IUPAC Name]
3-(2,6-Dichlorophényl)-5-méthyl-N-[5-(phénoxyméthyl)-1,3,4-thiadiazol-2-yl]-1,2-oxazole-4-carboxamide [French] [ACD/IUPAC Name]
3-(2,6-Dichlorphenyl)-5-methyl-N-[5-(phenoxymethyl)-1,3,4-thiadiazol-2-yl]-1,2-oxazol-4-carboxamid [German] [ACD/IUPAC Name]
4-Isoxazolecarboxamide, 3-(2,6-dichlorophenyl)-5-methyl-N-[5-(phenoxymethyl)-1,3,4-thiadiazol-2-yl]- [ACD/Index Name]
3-(2,6-Dichloro-phenyl)-5-methyl-isoxazole-4-carboxylic acid (5-phenoxymethyl-[1,3,4]thiadiazol-2-yl)-amide

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: 1.672
Molar Refractivity: 116.2±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.75
ACD/LogD (pH 5.5): 4.50
ACD/BCF (pH 5.5): 1548.47
ACD/KOC (pH 5.5): 6651.92
ACD/LogD (pH 7.4): 4.15
ACD/BCF (pH 7.4): 693.52
ACD/KOC (pH 7.4): 2979.24
Polar Surface Area: 118 Å2
Polarizability: 46.0±0.5 10-24cm3
Surface Tension: 64.0±3.0 dyne/cm
Molar Volume: 310.4±3.0 cm3

Click to predict properties on the Chemicalize site


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