N'-[(4,6-dichloro-2H-1-benzothiopyran-3-yl)methylidene]-1-phenyl-5-(trifluoromethyl)-1H-pyrazole-4-carbohydrazide
Chemical Structure Depiction of
N'-[(4,6-dichloro-2H-1-benzothiopyran-3-yl)methylidene]-1-phenyl-5-(trifluoromethyl)-1H-pyrazole-4-carbohydrazide
N'-[(4,6-dichloro-2H-1-benzothiopyran-3-yl)methylidene]-1-phenyl-5-(trifluoromethyl)-1H-pyrazole-4-carbohydrazide
Compound characteristics
| Compound ID: | K072-0023 |
| Compound Name: | N'-[(4,6-dichloro-2H-1-benzothiopyran-3-yl)methylidene]-1-phenyl-5-(trifluoromethyl)-1H-pyrazole-4-carbohydrazide |
| Molecular Weight: | 497.32 |
| Molecular Formula: | C21 H13 Cl2 F3 N4 O S |
| Smiles: | [H]C(\C1CSc2ccc(cc2C=1[Cl])[Cl])=N/NC(c1cnn(c2ccccc2)c1C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 6.1292 |
| logD: | 3.6486 |
| logSw: | -6.2059 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.569 |
| InChI Key: | PTHYFKSXCHVNGY-UHFFFAOYSA-N |