2-methyl-N-[2-(methylcarbamoyl)phenyl]-5,6-dihydro-1,4-oxathiine-3-carboxamide
Chemical Structure Depiction of
2-methyl-N-[2-(methylcarbamoyl)phenyl]-5,6-dihydro-1,4-oxathiine-3-carboxamide
2-methyl-N-[2-(methylcarbamoyl)phenyl]-5,6-dihydro-1,4-oxathiine-3-carboxamide
Compound characteristics
| Compound ID: | E532-0204 |
| Compound Name: | 2-methyl-N-[2-(methylcarbamoyl)phenyl]-5,6-dihydro-1,4-oxathiine-3-carboxamide |
| Molecular Weight: | 292.35 |
| Molecular Formula: | C14 H16 N2 O3 S |
| Smiles: | CC1=C(C(Nc2ccccc2C(NC)=O)=O)SCCO1 |
| Stereo: | ACHIRAL |
| logP: | 0.5753 |
| logD: | 0.1647 |
| logSw: | -2.4645 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.738 |
| InChI Key: | MRFGYJVDACFNQG-UHFFFAOYSA-N |