2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide
Chemical Structure Depiction of
2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide
2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide
Compound characteristics
| Compound ID: | Y020-1928 |
| Compound Name: | 2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide |
| Molecular Weight: | 424.52 |
| Molecular Formula: | C22 H24 N4 O3 S |
| Smiles: | Cc1ccc2c(c1)sc(NC(CN1CCN(CC1)Cc1ccc3c(c1)OCO3)=O)n2 |
| Stereo: | ACHIRAL |
| logP: | 4.0347 |
| logD: | 3.2031 |
| logSw: | -3.9881 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.538 |
| InChI Key: | DXKFZGVSCPRTBY-UHFFFAOYSA-N |