2-ethoxyethyl 10-[2-(4-fluoroanilino)-2-oxoethyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate
Chemical Structure Depiction of
2-ethoxyethyl 10-[2-(4-fluoroanilino)-2-oxoethyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate
2-ethoxyethyl 10-[2-(4-fluoroanilino)-2-oxoethyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate
Compound characteristics
| Compound ID: | G599-0027 |
| Compound Name: | 2-ethoxyethyl 10-[2-(4-fluoroanilino)-2-oxoethyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate |
| Molecular Weight: | 494.54 |
| Molecular Formula: | C26 H23 F N2 O5 S |
| Smiles: | CCOCCOC(c1ccc2c(c1)N(CC(Nc1ccc(cc1)F)=O)C(c1ccccc1S2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9983 |
| logD: | 4.9982 |
| logSw: | -4.5513 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.575 |
| InChI Key: | MBVKCGBVBVGIJK-UHFFFAOYSA-N |