ethyl 10-[2-(3-fluoro-4-methylanilino)-2-oxoethyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate
Chemical Structure Depiction of
ethyl 10-[2-(3-fluoro-4-methylanilino)-2-oxoethyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate
ethyl 10-[2-(3-fluoro-4-methylanilino)-2-oxoethyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate
Compound characteristics
| Compound ID: | G599-0309 |
| Compound Name: | ethyl 10-[2-(3-fluoro-4-methylanilino)-2-oxoethyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate |
| Molecular Weight: | 464.51 |
| Molecular Formula: | C25 H21 F N2 O4 S |
| Smiles: | CCOC(c1ccc2c(c1)N(CC(Nc1ccc(C)c(c1)F)=O)C(c1ccccc1S2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8841 |
| logD: | 5.8839 |
| logSw: | -5.4304 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.304 |
| InChI Key: | SWIQPKCWPSPEFC-UHFFFAOYSA-N |