methyl 10-{[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]methyl}-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate
Chemical Structure Depiction of
methyl 10-{[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]methyl}-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate
methyl 10-{[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]methyl}-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate
Compound characteristics
| Compound ID: | G599-0208 |
| Compound Name: | methyl 10-{[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]methyl}-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxylate |
| Molecular Weight: | 470.55 |
| Molecular Formula: | C27 H22 N2 O4 S |
| Smiles: | Cc1ccc(cc1)c1nc(CN2C(c3ccccc3Sc3ccc(cc23)C(=O)OC)=O)c(C)o1 |
| Stereo: | ACHIRAL |
| logP: | 6.1477 |
| logD: | 6.1477 |
| logSw: | -5.4682 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 54.696 |
| InChI Key: | OSMIISCSZDZSEC-UHFFFAOYSA-N |