N-(6-cyano-2H-1,3-benzodioxol-5-yl)-2-(2-oxo-1,3-benzothiazol-3(2H)-yl)acetamide
Chemical Structure Depiction of
N-(6-cyano-2H-1,3-benzodioxol-5-yl)-2-(2-oxo-1,3-benzothiazol-3(2H)-yl)acetamide
N-(6-cyano-2H-1,3-benzodioxol-5-yl)-2-(2-oxo-1,3-benzothiazol-3(2H)-yl)acetamide
Compound characteristics
| Compound ID: | 8017-0938 |
| Compound Name: | N-(6-cyano-2H-1,3-benzodioxol-5-yl)-2-(2-oxo-1,3-benzothiazol-3(2H)-yl)acetamide |
| Molecular Weight: | 353.35 |
| Molecular Formula: | C17 H11 N3 O4 S |
| Smiles: | C(C(Nc1cc2c(cc1C#N)OCO2)=O)N1C(=O)Sc2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 2.5049 |
| logD: | 2.4855 |
| logSw: | -3.2075 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.435 |
| InChI Key: | VTRUVAHIZIKNLR-UHFFFAOYSA-N |