ethyl 4-[(1-methyl-5,5-dioxo-4,5-dihydro-1H-5lambda~6~-[1]benzothiopyrano[4,3-c]pyrazole-3-carbonyl)amino]piperidine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-[(1-methyl-5,5-dioxo-4,5-dihydro-1H-5lambda~6~-[1]benzothiopyrano[4,3-c]pyrazole-3-carbonyl)amino]piperidine-1-carboxylate
ethyl 4-[(1-methyl-5,5-dioxo-4,5-dihydro-1H-5lambda~6~-[1]benzothiopyrano[4,3-c]pyrazole-3-carbonyl)amino]piperidine-1-carboxylate
Compound characteristics
| Compound ID: | E207-1435 |
| Compound Name: | ethyl 4-[(1-methyl-5,5-dioxo-4,5-dihydro-1H-5lambda~6~-[1]benzothiopyrano[4,3-c]pyrazole-3-carbonyl)amino]piperidine-1-carboxylate |
| Molecular Weight: | 432.5 |
| Molecular Formula: | C20 H24 N4 O5 S |
| Smiles: | CCOC(N1CCC(CC1)NC(c1c2CS(c3ccccc3c2n(C)n1)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2472 |
| logD: | 1.2472 |
| logSw: | -2.3898 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.006 |
| InChI Key: | KTVCGLSEUZPODP-UHFFFAOYSA-N |