ethyl 10-[(2-chloro-4-fluorophenyl)methyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate
Chemical Structure Depiction of
ethyl 10-[(2-chloro-4-fluorophenyl)methyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate
ethyl 10-[(2-chloro-4-fluorophenyl)methyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate
Compound characteristics
| Compound ID: | G599-0081 |
| Compound Name: | ethyl 10-[(2-chloro-4-fluorophenyl)methyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate |
| Molecular Weight: | 441.91 |
| Molecular Formula: | C23 H17 Cl F N O3 S |
| Smiles: | CCOC(c1ccc2c(c1)N(Cc1ccc(cc1[Cl])F)C(c1ccccc1S2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.5533 |
| logD: | 6.5533 |
| logSw: | -6.0051 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 36.154 |
| InChI Key: | UBWCPAIGKBJGSR-UHFFFAOYSA-N |