ethyl 10-{[2-(2,5-dimethylphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate
Chemical Structure Depiction of
ethyl 10-{[2-(2,5-dimethylphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate
ethyl 10-{[2-(2,5-dimethylphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate
Compound characteristics
| Compound ID: | G599-0083 |
| Compound Name: | ethyl 10-{[2-(2,5-dimethylphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate |
| Molecular Weight: | 498.6 |
| Molecular Formula: | C29 H26 N2 O4 S |
| Smiles: | CCOC(c1ccc2c(c1)N(Cc1c(C)oc(c3cc(C)ccc3C)n1)C(c1ccccc1S2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 7.003 |
| logD: | 7.003 |
| logSw: | -5.5653 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 54.276 |
| InChI Key: | NVXHBYXWXKNFSB-UHFFFAOYSA-N |