1-methyl-5,5-dioxo-N-[3-(2-oxopyrrolidin-1-yl)propyl]-4,5-dihydro-1H-5lambda~6~-[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
Chemical Structure Depiction of
1-methyl-5,5-dioxo-N-[3-(2-oxopyrrolidin-1-yl)propyl]-4,5-dihydro-1H-5lambda~6~-[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
1-methyl-5,5-dioxo-N-[3-(2-oxopyrrolidin-1-yl)propyl]-4,5-dihydro-1H-5lambda~6~-[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | E207-1434 |
| Compound Name: | 1-methyl-5,5-dioxo-N-[3-(2-oxopyrrolidin-1-yl)propyl]-4,5-dihydro-1H-5lambda~6~-[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide |
| Molecular Weight: | 402.47 |
| Molecular Formula: | C19 H22 N4 O4 S |
| Smiles: | Cn1c2c3ccccc3S(Cc2c(C(NCCCN2CCCC2=O)=O)n1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.2779 |
| logD: | -0.2779 |
| logSw: | -2.0894 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.854 |
| InChI Key: | MUCQVPGSJLGYPI-UHFFFAOYSA-N |