N-{2-[(4-phenylbutan-2-yl)carbamoyl]phenyl}-5,6-dihydro-1,4-oxathiine-2-carboxamide
Chemical Structure Depiction of
N-{2-[(4-phenylbutan-2-yl)carbamoyl]phenyl}-5,6-dihydro-1,4-oxathiine-2-carboxamide
N-{2-[(4-phenylbutan-2-yl)carbamoyl]phenyl}-5,6-dihydro-1,4-oxathiine-2-carboxamide
Compound characteristics
| Compound ID: | G370-0861 |
| Compound Name: | N-{2-[(4-phenylbutan-2-yl)carbamoyl]phenyl}-5,6-dihydro-1,4-oxathiine-2-carboxamide |
| Molecular Weight: | 396.51 |
| Molecular Formula: | C22 H24 N2 O3 S |
| Smiles: | CC(CCc1ccccc1)NC(c1ccccc1NC(C1=CSCCO1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3592 |
| logD: | 3.1301 |
| logSw: | -3.8404 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.115 |
| InChI Key: | MWWWFMYDHIRBHW-INIZCTEOSA-N |