N-[2-(methylcarbamoyl)phenyl]-5,6-dihydro-1,4-oxathiine-2-carboxamide
Chemical Structure Depiction of
N-[2-(methylcarbamoyl)phenyl]-5,6-dihydro-1,4-oxathiine-2-carboxamide
N-[2-(methylcarbamoyl)phenyl]-5,6-dihydro-1,4-oxathiine-2-carboxamide
Compound characteristics
| Compound ID: | G370-0891 |
| Compound Name: | N-[2-(methylcarbamoyl)phenyl]-5,6-dihydro-1,4-oxathiine-2-carboxamide |
| Molecular Weight: | 278.33 |
| Molecular Formula: | C13 H14 N2 O3 S |
| Smiles: | CNC(c1ccccc1NC(C1=CSCCO1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.7153 |
| logD: | 0.4862 |
| logSw: | -2.2885 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.096 |
| InChI Key: | MVIXBNDDCGMBID-UHFFFAOYSA-N |