ethyl 10-[1-(2-methoxyanilino)-1-oxobutan-2-yl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate
Chemical Structure Depiction of
ethyl 10-[1-(2-methoxyanilino)-1-oxobutan-2-yl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate
ethyl 10-[1-(2-methoxyanilino)-1-oxobutan-2-yl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate
Compound characteristics
| Compound ID: | G599-0350 |
| Compound Name: | ethyl 10-[1-(2-methoxyanilino)-1-oxobutan-2-yl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate |
| Molecular Weight: | 490.58 |
| Molecular Formula: | C27 H26 N2 O5 S |
| Smiles: | CCC(C(Nc1ccccc1OC)=O)N1C(c2ccccc2Sc2ccc(cc12)C(=O)OCC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.8939 |
| logD: | 5.8937 |
| logSw: | -5.4641 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.375 |
| InChI Key: | QMXFWFWSVDQUAR-FQEVSTJZSA-N |