N-[2-methyl-5-(methylcarbamoyl)phenyl]-5,6-dihydro-1,4-oxathiine-2-carboxamide
Chemical Structure Depiction of
N-[2-methyl-5-(methylcarbamoyl)phenyl]-5,6-dihydro-1,4-oxathiine-2-carboxamide
N-[2-methyl-5-(methylcarbamoyl)phenyl]-5,6-dihydro-1,4-oxathiine-2-carboxamide
Compound characteristics
| Compound ID: | G370-1549 |
| Compound Name: | N-[2-methyl-5-(methylcarbamoyl)phenyl]-5,6-dihydro-1,4-oxathiine-2-carboxamide |
| Molecular Weight: | 292.35 |
| Molecular Formula: | C14 H16 N2 O3 S |
| Smiles: | Cc1ccc(cc1NC(C1=CSCCO1)=O)C(NC)=O |
| Stereo: | ACHIRAL |
| logP: | 1.0675 |
| logD: | 1.0622 |
| logSw: | -2.2691 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.096 |
| InChI Key: | BGEJSMLHXRDEAX-UHFFFAOYSA-N |