2-ethoxyethyl 10-{[3-(ethoxycarbonyl)-1,2-oxazol-5-yl]methyl}-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate
Chemical Structure Depiction of
2-ethoxyethyl 10-{[3-(ethoxycarbonyl)-1,2-oxazol-5-yl]methyl}-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate
2-ethoxyethyl 10-{[3-(ethoxycarbonyl)-1,2-oxazol-5-yl]methyl}-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate
Compound characteristics
| Compound ID: | G599-0021 |
| Compound Name: | 2-ethoxyethyl 10-{[3-(ethoxycarbonyl)-1,2-oxazol-5-yl]methyl}-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate |
| Molecular Weight: | 496.54 |
| Molecular Formula: | C25 H24 N2 O7 S |
| Smiles: | CCOCCOC(c1ccc2c(c1)N(Cc1cc(C(=O)OCC)no1)C(c1ccccc1S2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.667 |
| logD: | 4.667 |
| logSw: | -4.4175 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 86.157 |
| InChI Key: | DLWGHMZLTZVBFI-UHFFFAOYSA-N |