N-(2H-1,3-benzodioxol-5-yl)-2,3-dimethyl-4H-thieno[3,2-c]thiopyran-6-carboxamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-2,3-dimethyl-4H-thieno[3,2-c]thiopyran-6-carboxamide
N-(2H-1,3-benzodioxol-5-yl)-2,3-dimethyl-4H-thieno[3,2-c]thiopyran-6-carboxamide
Compound characteristics
| Compound ID: | E722-1351 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-2,3-dimethyl-4H-thieno[3,2-c]thiopyran-6-carboxamide |
| Molecular Weight: | 345.44 |
| Molecular Formula: | C17 H15 N O3 S2 |
| Smiles: | Cc1c2CSC(=Cc2sc1C)C(Nc1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4732 |
| logD: | 4.4732 |
| logSw: | -4.3668 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.384 |
| InChI Key: | IYKCDSVUGFWFKS-UHFFFAOYSA-N |