1-methyl-N-({1-[(3-methylphenyl)methyl]piperidin-4-yl}methyl)-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
Chemical Structure Depiction of
1-methyl-N-({1-[(3-methylphenyl)methyl]piperidin-4-yl}methyl)-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
1-methyl-N-({1-[(3-methylphenyl)methyl]piperidin-4-yl}methyl)-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | G541-1244 |
| Compound Name: | 1-methyl-N-({1-[(3-methylphenyl)methyl]piperidin-4-yl}methyl)-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide |
| Molecular Weight: | 446.61 |
| Molecular Formula: | C26 H30 N4 O S |
| Smiles: | Cc1cccc(CN2CCC(CC2)CNC(c2c3CSc4ccccc4c3n(C)n2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.2303 |
| logD: | 1.738 |
| logSw: | -4.3185 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.707 |
| InChI Key: | NUNQMHBUEHQKNK-UHFFFAOYSA-N |