ethyl 10-[2-(4-ethylanilino)-2-oxoethyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate
Chemical Structure Depiction of
ethyl 10-[2-(4-ethylanilino)-2-oxoethyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate
ethyl 10-[2-(4-ethylanilino)-2-oxoethyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate
Compound characteristics
| Compound ID: | G599-0099 |
| Compound Name: | ethyl 10-[2-(4-ethylanilino)-2-oxoethyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate |
| Molecular Weight: | 460.55 |
| Molecular Formula: | C26 H24 N2 O4 S |
| Smiles: | CCc1ccc(cc1)NC(CN1C(c2ccccc2Sc2ccc(cc12)C(=O)OCC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.165 |
| logD: | 6.165 |
| logSw: | -5.4474 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.304 |
| InChI Key: | ACNDQJAKTQWWKN-UHFFFAOYSA-N |