ethyl 1-[8-methyl-11-oxo-2-(piperidine-1-sulfonyl)-10,11-dihydrodibenzo[b,f][1,4]oxazepin-3-yl]piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-[8-methyl-11-oxo-2-(piperidine-1-sulfonyl)-10,11-dihydrodibenzo[b,f][1,4]oxazepin-3-yl]piperidine-4-carboxylate
ethyl 1-[8-methyl-11-oxo-2-(piperidine-1-sulfonyl)-10,11-dihydrodibenzo[b,f][1,4]oxazepin-3-yl]piperidine-4-carboxylate
Compound characteristics
| Compound ID: | J030-0859 |
| Compound Name: | ethyl 1-[8-methyl-11-oxo-2-(piperidine-1-sulfonyl)-10,11-dihydrodibenzo[b,f][1,4]oxazepin-3-yl]piperidine-4-carboxylate |
| Molecular Weight: | 527.64 |
| Molecular Formula: | C27 H33 N3 O6 S |
| Smiles: | CCOC(C1CCN(CC1)c1cc2c(cc1S(N1CCCCC1)(=O)=O)C(Nc1cc(C)ccc1O2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4293 |
| logD: | 4.3831 |
| logSw: | -4.307 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.956 |
| InChI Key: | ZJUCJIUCEKVDLI-UHFFFAOYSA-N |