ChemSpider 2D Image | Methyl 6-{[(2-{[1-methyl-3-(trifluoromethyl)-1H-thieno[2,3-c]pyrazol-5-yl]carbonyl}hydrazino)carbonyl]amino}hexanoate | C16H20F3N5O4S

Methyl 6-{[(2-{[1-methyl-3-(trifluoromethyl)-1H-thieno[2,3-c]pyrazol-5-yl]carbonyl}hydrazino)carbonyl]amino}hexanoate

  • Molecular FormulaC16H20F3N5O4S
  • Average mass435.421 Da
  • Monoisotopic mass435.118805 Da
  • ChemSpider ID102248373

More details:

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

1H-Thieno[2,3-c]pyrazole-5-carboxylic acid, 1-methyl-3-(trifluoromethyl)-, 2-[[(6-methoxy-6-oxohexyl)amino]carbonyl]hydrazide [ACD/Index Name]
6-{[(2-{[1-Méthyl-3-(trifluorométhyl)-1H-thiéno[2,3-c]pyrazol-5-yl]carbonyl}hydrazino)carbonyl]amino}hexanoate de méthyle [French] [ACD/IUPAC Name]
Methyl 6-{[(2-{[1-methyl-3-(trifluoromethyl)-1H-thieno[2,3-c]pyrazol-5-yl]carbonyl}hydrazino)carbonyl]amino}hexanoate [ACD/IUPAC Name]
Methyl-6-{[(2-{[1-methyl-3-(trifluormethyl)-1H-thieno[2,3-c]pyrazol-5-yl]carbonyl}hydrazino)carbonyl]amino}hexanoat [German] [ACD/IUPAC Name]

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: 1.603
Molar Refractivity: 98.9±0.5 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 2.84
ACD/LogD (pH 5.5): 1.83
ACD/BCF (pH 5.5): 14.54
ACD/KOC (pH 5.5): 236.46
ACD/LogD (pH 7.4): 1.83
ACD/BCF (pH 7.4): 14.37
ACD/KOC (pH 7.4): 233.65
Polar Surface Area: 143 Å2
Polarizability: 39.2±0.5 10-24cm3
Surface Tension: 49.1±7.0 dyne/cm
Molar Volume: 287.8±7.0 cm3

Click to predict properties on the Chemicalize site


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