N'-[1-(2H-1,3-benzodioxol-5-yl)ethylidene]-1-phenyl-5-(trifluoromethyl)-1H-pyrazole-4-carbohydrazide
Chemical Structure Depiction of
N'-[1-(2H-1,3-benzodioxol-5-yl)ethylidene]-1-phenyl-5-(trifluoromethyl)-1H-pyrazole-4-carbohydrazide
N'-[1-(2H-1,3-benzodioxol-5-yl)ethylidene]-1-phenyl-5-(trifluoromethyl)-1H-pyrazole-4-carbohydrazide
Compound characteristics
Compound ID: | K007-0937 |
Compound Name: | N'-[1-(2H-1,3-benzodioxol-5-yl)ethylidene]-1-phenyl-5-(trifluoromethyl)-1H-pyrazole-4-carbohydrazide |
Molecular Weight: | 416.36 |
Molecular Formula: | C20 H15 F3 N4 O3 |
Smiles: | C/C(c1ccc2c(c1)OCO2)=N/NC(c1cnn(c2ccccc2)c1C(F)(F)F)=O |
Stereo: | ACHIRAL |
logP: | 3.9736 |
logD: | 3.2812 |
logSw: | -4.1015 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 65.052 |
InChI Key: | MMUDLTUOFSXKNR-UHFFFAOYSA-N |