ethyl 1-{10-[(2-methylphenyl)methyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carbonyl}piperidine-3-carboxylate
Chemical Structure Depiction of
ethyl 1-{10-[(2-methylphenyl)methyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carbonyl}piperidine-3-carboxylate
ethyl 1-{10-[(2-methylphenyl)methyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carbonyl}piperidine-3-carboxylate
Compound characteristics
| Compound ID: | K788-1013 |
| Compound Name: | ethyl 1-{10-[(2-methylphenyl)methyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carbonyl}piperidine-3-carboxylate |
| Molecular Weight: | 514.64 |
| Molecular Formula: | C30 H30 N2 O4 S |
| Smiles: | CCOC(C1CCCN(C1)C(c1ccc2c(c1)N(Cc1ccccc1C)C(c1ccccc1S2)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.7427 |
| logD: | 5.7427 |
| logSw: | -5.2884 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 52.736 |
| InChI Key: | JHTUVZPHKHNXTL-QHCPKHFHSA-N |