N-{3-[4-(2,5-dimethylphenyl)piperazin-1-yl]propyl}-1,8-dimethyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
Chemical Structure Depiction of
N-{3-[4-(2,5-dimethylphenyl)piperazin-1-yl]propyl}-1,8-dimethyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
N-{3-[4-(2,5-dimethylphenyl)piperazin-1-yl]propyl}-1,8-dimethyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | G541-0672 |
| Compound Name: | N-{3-[4-(2,5-dimethylphenyl)piperazin-1-yl]propyl}-1,8-dimethyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide |
| Molecular Weight: | 489.68 |
| Molecular Formula: | C28 H35 N5 O S |
| Smiles: | Cc1ccc2c(c1)c1c(CS2)c(C(NCCCN2CCN(CC2)c2cc(C)ccc2C)=O)nn1C |
| Stereo: | ACHIRAL |
| logP: | 4.6293 |
| logD: | 3.4828 |
| logSw: | -4.2719 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.758 |
| InChI Key: | XTHOZYRVYYONKU-UHFFFAOYSA-N |