N-(5-{[(2-methoxyphenyl)methyl]carbamoyl}-2-methylphenyl)-5,6-dihydro-1,4-oxathiine-2-carboxamide
Chemical Structure Depiction of
N-(5-{[(2-methoxyphenyl)methyl]carbamoyl}-2-methylphenyl)-5,6-dihydro-1,4-oxathiine-2-carboxamide
N-(5-{[(2-methoxyphenyl)methyl]carbamoyl}-2-methylphenyl)-5,6-dihydro-1,4-oxathiine-2-carboxamide
Compound characteristics
| Compound ID: | G370-1489 |
| Compound Name: | N-(5-{[(2-methoxyphenyl)methyl]carbamoyl}-2-methylphenyl)-5,6-dihydro-1,4-oxathiine-2-carboxamide |
| Molecular Weight: | 398.48 |
| Molecular Formula: | C21 H22 N2 O4 S |
| Smiles: | Cc1ccc(cc1NC(C1=CSCCO1)=O)C(NCc1ccccc1OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8662 |
| logD: | 2.8609 |
| logSw: | -3.3498 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.304 |
| InChI Key: | XGWMKSRTRGHJMV-UHFFFAOYSA-N |