2-ethoxyethyl 10-[(2-chloro-4-fluorophenyl)methyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate
Chemical Structure Depiction of
2-ethoxyethyl 10-[(2-chloro-4-fluorophenyl)methyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate
2-ethoxyethyl 10-[(2-chloro-4-fluorophenyl)methyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate
Compound characteristics
| Compound ID: | G599-0016 |
| Compound Name: | 2-ethoxyethyl 10-[(2-chloro-4-fluorophenyl)methyl]-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate |
| Molecular Weight: | 485.96 |
| Molecular Formula: | C25 H21 Cl F N O4 S |
| Smiles: | CCOCCOC(c1ccc2c(c1)N(Cc1ccc(cc1[Cl])F)C(c1ccccc1S2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.2881 |
| logD: | 6.2881 |
| logSw: | -5.9254 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 44.426 |
| InChI Key: | NGJDLVNDHAODMA-UHFFFAOYSA-N |