ethyl 10-{2-[ethyl(3-methylphenyl)amino]-2-oxoethyl}-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate
Chemical Structure Depiction of
ethyl 10-{2-[ethyl(3-methylphenyl)amino]-2-oxoethyl}-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate
ethyl 10-{2-[ethyl(3-methylphenyl)amino]-2-oxoethyl}-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate
Compound characteristics
| Compound ID: | G599-0104 |
| Compound Name: | ethyl 10-{2-[ethyl(3-methylphenyl)amino]-2-oxoethyl}-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate |
| Molecular Weight: | 474.58 |
| Molecular Formula: | C27 H26 N2 O4 S |
| Smiles: | CCN(C(CN1C(c2ccccc2Sc2ccc(cc12)C(=O)OCC)=O)=O)c1cccc(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.7819 |
| logD: | 5.7819 |
| logSw: | -5.4496 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 51.246 |
| InChI Key: | KDLGSFQFJKKZNA-UHFFFAOYSA-N |