N-cyclohexyl-1-methyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
Chemical Structure Depiction of
N-cyclohexyl-1-methyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
N-cyclohexyl-1-methyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | C660-1352 |
| Compound Name: | N-cyclohexyl-1-methyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide |
| Molecular Weight: | 327.45 |
| Molecular Formula: | C18 H21 N3 O S |
| Smiles: | Cn1c2c3ccccc3SCc2c(C(NC2CCCCC2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.2564 |
| logD: | 3.2564 |
| logSw: | -3.8125 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.7 |
| InChI Key: | AOIRFVLUKQTLPX-UHFFFAOYSA-N |