ethyl 1-[11-oxo-2-(pyrrolidine-1-sulfonyl)-10,11-dihydrodibenzo[b,f][1,4]oxazepin-3-yl]piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-[11-oxo-2-(pyrrolidine-1-sulfonyl)-10,11-dihydrodibenzo[b,f][1,4]oxazepin-3-yl]piperidine-4-carboxylate
ethyl 1-[11-oxo-2-(pyrrolidine-1-sulfonyl)-10,11-dihydrodibenzo[b,f][1,4]oxazepin-3-yl]piperidine-4-carboxylate
Compound characteristics
| Compound ID: | J030-0467 |
| Compound Name: | ethyl 1-[11-oxo-2-(pyrrolidine-1-sulfonyl)-10,11-dihydrodibenzo[b,f][1,4]oxazepin-3-yl]piperidine-4-carboxylate |
| Molecular Weight: | 499.59 |
| Molecular Formula: | C25 H29 N3 O6 S |
| Smiles: | CCOC(C1CCN(CC1)c1cc2c(cc1S(N1CCCC1)(=O)=O)C(Nc1ccccc1O2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0149 |
| logD: | 3.9467 |
| logSw: | -4.1171 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.322 |
| InChI Key: | ZGRYCMRUTNAYEW-UHFFFAOYSA-N |