1-methyl-N-[2-(4-methylpiperidin-1-yl)ethyl]-5,5-dioxo-4,5-dihydro-1H-5lambda~6~-[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
Chemical Structure Depiction of
1-methyl-N-[2-(4-methylpiperidin-1-yl)ethyl]-5,5-dioxo-4,5-dihydro-1H-5lambda~6~-[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
1-methyl-N-[2-(4-methylpiperidin-1-yl)ethyl]-5,5-dioxo-4,5-dihydro-1H-5lambda~6~-[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | C660-0602 |
| Compound Name: | 1-methyl-N-[2-(4-methylpiperidin-1-yl)ethyl]-5,5-dioxo-4,5-dihydro-1H-5lambda~6~-[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide |
| Molecular Weight: | 402.51 |
| Molecular Formula: | C20 H26 N4 O3 S |
| Smiles: | CC1CCN(CC1)CCNC(c1c2CS(c3ccccc3c2n(C)n1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4681 |
| logD: | 0.2838 |
| logSw: | -2.3164 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.324 |
| InChI Key: | UFNXQRJACBQJET-UHFFFAOYSA-N |