ethyl 1-{5-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]-2-methoxybenzene-1-sulfonyl}piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-{5-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]-2-methoxybenzene-1-sulfonyl}piperidine-4-carboxylate
ethyl 1-{5-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]-2-methoxybenzene-1-sulfonyl}piperidine-4-carboxylate
Compound characteristics
| Compound ID: | E912-0259 |
| Compound Name: | ethyl 1-{5-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]-2-methoxybenzene-1-sulfonyl}piperidine-4-carboxylate |
| Molecular Weight: | 487.53 |
| Molecular Formula: | C23 H25 N3 O7 S |
| Smiles: | CCOC(C1CCN(CC1)S(c1cc(CN2C(c3cccnc3C2=O)=O)ccc1OC)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2416 |
| logD: | 1.2416 |
| logSw: | -2.489 |
| Hydrogen bond acceptors count: | 14 |
| Polar surface area: | 99.495 |
| InChI Key: | CDJJHWIZZVHUFK-UHFFFAOYSA-N |