ethyl 11-oxo-10-{[3-(trifluoromethyl)phenyl]methyl}-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate
Chemical Structure Depiction of
ethyl 11-oxo-10-{[3-(trifluoromethyl)phenyl]methyl}-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate
ethyl 11-oxo-10-{[3-(trifluoromethyl)phenyl]methyl}-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate
Compound characteristics
| Compound ID: | G599-0076 |
| Compound Name: | ethyl 11-oxo-10-{[3-(trifluoromethyl)phenyl]methyl}-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate |
| Molecular Weight: | 457.47 |
| Molecular Formula: | C24 H18 F3 N O3 S |
| Smiles: | CCOC(c1ccc2c(c1)N(Cc1cccc(c1)C(F)(F)F)C(c1ccccc1S2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.5853 |
| logD: | 6.5853 |
| logSw: | -5.736 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 36.154 |
| InChI Key: | ULXWNVRJNVQOIP-UHFFFAOYSA-N |