N-[3-(4-cyclohexylpiperazin-1-yl)propyl]-1-methyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
Chemical Structure Depiction of
N-[3-(4-cyclohexylpiperazin-1-yl)propyl]-1-methyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
N-[3-(4-cyclohexylpiperazin-1-yl)propyl]-1-methyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | G541-1338 |
| Compound Name: | N-[3-(4-cyclohexylpiperazin-1-yl)propyl]-1-methyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide |
| Molecular Weight: | 453.65 |
| Molecular Formula: | C25 H35 N5 O S |
| Smiles: | Cn1c2c3ccccc3SCc2c(C(NCCCN2CCN(CC2)C2CCCCC2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.9088 |
| logD: | 1.9984 |
| logSw: | -3.5473 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.892 |
| InChI Key: | MHRORHSNOSNAGU-UHFFFAOYSA-N |