N-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]carbamoyl}phenyl)-5,6-dihydro-1,4-oxathiine-2-carboxamide
Chemical Structure Depiction of
N-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]carbamoyl}phenyl)-5,6-dihydro-1,4-oxathiine-2-carboxamide
N-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]carbamoyl}phenyl)-5,6-dihydro-1,4-oxathiine-2-carboxamide
Compound characteristics
| Compound ID: | G370-0792 |
| Compound Name: | N-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]carbamoyl}phenyl)-5,6-dihydro-1,4-oxathiine-2-carboxamide |
| Molecular Weight: | 398.44 |
| Molecular Formula: | C20 H18 N2 O5 S |
| Smiles: | C(c1ccc2c(c1)OCO2)NC(c1ccccc1NC(C1=CSCCO1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5037 |
| logD: | 2.3625 |
| logSw: | -3.1328 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.789 |
| InChI Key: | HYUOKXBRJKKHIB-UHFFFAOYSA-N |