N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(4-methylpiperidin-1-yl)-1,3-benzothiazole-6-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(4-methylpiperidin-1-yl)-1,3-benzothiazole-6-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(4-methylpiperidin-1-yl)-1,3-benzothiazole-6-carboxamide
Compound characteristics
| Compound ID: | C858-0948 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(4-methylpiperidin-1-yl)-1,3-benzothiazole-6-carboxamide |
| Molecular Weight: | 409.51 |
| Molecular Formula: | C22 H23 N3 O3 S |
| Smiles: | CC1CCN(CC1)c1nc2ccc(cc2s1)C(NCc1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6884 |
| logD: | 4.6875 |
| logSw: | -4.4497 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.755 |
| InChI Key: | PQWKWCCNJVEOGQ-UHFFFAOYSA-N |