N-[(2-bromophenyl)methyl]-2-(4-methylpiperidin-1-yl)-1,3-benzothiazole-6-carboxamide
Chemical Structure Depiction of
N-[(2-bromophenyl)methyl]-2-(4-methylpiperidin-1-yl)-1,3-benzothiazole-6-carboxamide
N-[(2-bromophenyl)methyl]-2-(4-methylpiperidin-1-yl)-1,3-benzothiazole-6-carboxamide
Compound characteristics
| Compound ID: | C797-0158 |
| Compound Name: | N-[(2-bromophenyl)methyl]-2-(4-methylpiperidin-1-yl)-1,3-benzothiazole-6-carboxamide |
| Molecular Weight: | 444.39 |
| Molecular Formula: | C21 H22 Br N3 O S |
| Smiles: | CC1CCN(CC1)c1nc2ccc(cc2s1)C(NCc1ccccc1[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 5.6473 |
| logD: | 5.6464 |
| logSw: | -5.5031 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.64 |
| InChI Key: | RUXUKBHOMIYEEG-UHFFFAOYSA-N |