N-[3-(4-benzylpiperazin-1-yl)propyl]-1-methyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
Chemical Structure Depiction of
N-[3-(4-benzylpiperazin-1-yl)propyl]-1-methyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
N-[3-(4-benzylpiperazin-1-yl)propyl]-1-methyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | E146-1600 |
| Compound Name: | N-[3-(4-benzylpiperazin-1-yl)propyl]-1-methyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide |
| Molecular Weight: | 461.63 |
| Molecular Formula: | C26 H31 N5 O S |
| Smiles: | Cn1c2c3ccccc3SCc2c(C(NCCCN2CCN(CC2)Cc2ccccc2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.568 |
| logD: | 1.7971 |
| logSw: | -3.0945 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.339 |
| InChI Key: | NAZRHJMQRWQGDV-UHFFFAOYSA-N |