methyl 10-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]-5,5,11-trioxo-10,11-dihydro-5H-5lambda~6~-dibenzo[b,f][1,4]thiazepine-8-carboxylate
Chemical Structure Depiction of
methyl 10-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]-5,5,11-trioxo-10,11-dihydro-5H-5lambda~6~-dibenzo[b,f][1,4]thiazepine-8-carboxylate
methyl 10-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]-5,5,11-trioxo-10,11-dihydro-5H-5lambda~6~-dibenzo[b,f][1,4]thiazepine-8-carboxylate
Compound characteristics
| Compound ID: | F089-0042 |
| Compound Name: | methyl 10-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]-5,5,11-trioxo-10,11-dihydro-5H-5lambda~6~-dibenzo[b,f][1,4]thiazepine-8-carboxylate |
| Molecular Weight: | 488.52 |
| Molecular Formula: | C26 H20 N2 O6 S |
| Smiles: | Cc1c(CN2C(c3ccccc3S(c3ccc(cc23)C(=O)OC)(=O)=O)=O)nc(c2ccccc2)o1 |
| Stereo: | ACHIRAL |
| logP: | 4.0098 |
| logD: | 4.0098 |
| logSw: | -4.329 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 83.677 |
| InChI Key: | GPYUOPRGRFNBLK-UHFFFAOYSA-N |