N'-[(8-hydroxy-2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolin-9-yl)methylidene]-1-phenyl-5-(trifluoromethyl)-1H-pyrazole-4-carbohydrazide
Chemical Structure Depiction of
N'-[(8-hydroxy-2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolin-9-yl)methylidene]-1-phenyl-5-(trifluoromethyl)-1H-pyrazole-4-carbohydrazide
N'-[(8-hydroxy-2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolin-9-yl)methylidene]-1-phenyl-5-(trifluoromethyl)-1H-pyrazole-4-carbohydrazide
Compound characteristics
| Compound ID: | K048-0024 |
| Compound Name: | N'-[(8-hydroxy-2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolin-9-yl)methylidene]-1-phenyl-5-(trifluoromethyl)-1H-pyrazole-4-carbohydrazide |
| Molecular Weight: | 469.47 |
| Molecular Formula: | C24 H22 F3 N5 O2 |
| Smiles: | C1Cc2cc(/C=N/NC(c3cnn(c4ccccc4)c3C(F)(F)F)=O)c(c3CCCN(C1)c23)O |
| Stereo: | ACHIRAL |
| logP: | 4.5277 |
| logD: | 4.4335 |
| logSw: | -4.2443 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.011 |
| InChI Key: | VCPBURXDMBDFQW-XODNFHPESA-N |