ethyl 1-{4-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]benzene-1-sulfonyl}piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-{4-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]benzene-1-sulfonyl}piperidine-4-carboxylate
ethyl 1-{4-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]benzene-1-sulfonyl}piperidine-4-carboxylate
Compound characteristics
| Compound ID: | E734-2656 |
| Compound Name: | ethyl 1-{4-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]benzene-1-sulfonyl}piperidine-4-carboxylate |
| Molecular Weight: | 457.5 |
| Molecular Formula: | C22 H23 N3 O6 S |
| Smiles: | CCOC(C1CCN(CC1)S(c1ccc(CN2C(c3cccnc3C2=O)=O)cc1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3959 |
| logD: | 1.3959 |
| logSw: | -2.5148 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 91.865 |
| InChI Key: | WZELFIFLTPLLDG-UHFFFAOYSA-N |