ChemSpider 2D Image | N-[4-(3-Ethyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)benzyl]-3-fluorobenzamide | C19H16FN5OS

N-[4-(3-Ethyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)benzyl]-3-fluorobenzamide

  • Molecular FormulaC19H16FN5OS
  • Average mass381.427 Da
  • Monoisotopic mass381.105957 Da
  • ChemSpider ID21481097

More details:






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

Benzamide, N-[[4-(3-ethyl-1,2,4-triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]methyl]-3-fluoro- [ACD/Index Name]
N-[4-(3-Ethyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)benzyl]-3-fluorbenzamid [German] [ACD/IUPAC Name]
N-[4-(3-Ethyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)benzyl]-3-fluorobenzamide [ACD/IUPAC Name]
N-[4-(3-Éthyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)benzyl]-3-fluorobenzamide [French] [ACD/IUPAC Name]
MFCD11694244
N-[4-(3-Ethyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)-benzyl]-3-fluoro-benzamide

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.708
Molar Refractivity: 104.4±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.28
ACD/LogD (pH 5.5): 3.35
ACD/BCF (pH 5.5): 206.73
ACD/KOC (pH 5.5): 1581.16
ACD/LogD (pH 7.4): 3.35
ACD/BCF (pH 7.4): 206.73
ACD/KOC (pH 7.4): 1581.17
Polar Surface Area: 100 Å2
Polarizability: 41.4±0.5 10-24cm3
Surface Tension: 55.2±7.0 dyne/cm
Molar Volume: 267.8±7.0 cm3

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