N-(2H-1,3-benzodioxol-5-yl)-6-(3-oxo-1,2-benzothiazol-2(3H)-yl)hexanamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-6-(3-oxo-1,2-benzothiazol-2(3H)-yl)hexanamide
N-(2H-1,3-benzodioxol-5-yl)-6-(3-oxo-1,2-benzothiazol-2(3H)-yl)hexanamide
Compound characteristics
| Compound ID: | Y043-0647 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-6-(3-oxo-1,2-benzothiazol-2(3H)-yl)hexanamide |
| Molecular Weight: | 384.45 |
| Molecular Formula: | C20 H20 N2 O4 S |
| Smiles: | C(CCC(Nc1ccc2c(c1)OCO2)=O)CCN1C(c2ccccc2S1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0987 |
| logD: | 3.0986 |
| logSw: | -3.5513 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.87 |
| InChI Key: | MASOQWXNGWQAQY-UHFFFAOYSA-N |