N-[(2-ethoxyphenyl)methyl]-1-methyl-5,5-dioxo-4,5-dihydro-1H-5lambda~6~-[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
Chemical Structure Depiction of
N-[(2-ethoxyphenyl)methyl]-1-methyl-5,5-dioxo-4,5-dihydro-1H-5lambda~6~-[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
N-[(2-ethoxyphenyl)methyl]-1-methyl-5,5-dioxo-4,5-dihydro-1H-5lambda~6~-[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | E207-1433 |
| Compound Name: | N-[(2-ethoxyphenyl)methyl]-1-methyl-5,5-dioxo-4,5-dihydro-1H-5lambda~6~-[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide |
| Molecular Weight: | 411.48 |
| Molecular Formula: | C21 H21 N3 O4 S |
| Smiles: | CCOc1ccccc1CNC(c1c2CS(c3ccccc3c2n(C)n1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5077 |
| logD: | 2.5077 |
| logSw: | -2.8251 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.711 |
| InChI Key: | JCPYLTYIFXXRDI-UHFFFAOYSA-N |