N-[(4-fluorophenyl)methyl]-1,8-dimethyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
Chemical Structure Depiction of
N-[(4-fluorophenyl)methyl]-1,8-dimethyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
N-[(4-fluorophenyl)methyl]-1,8-dimethyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | G541-0435 |
| Compound Name: | N-[(4-fluorophenyl)methyl]-1,8-dimethyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide |
| Molecular Weight: | 367.44 |
| Molecular Formula: | C20 H18 F N3 O S |
| Smiles: | Cc1ccc2c(c1)c1c(CS2)c(C(NCc2ccc(cc2)F)=O)nn1C |
| Stereo: | ACHIRAL |
| logP: | 3.5744 |
| logD: | 3.5744 |
| logSw: | -3.8856 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.975 |
| InChI Key: | FZPAVWZVRAUXIZ-UHFFFAOYSA-N |