N-[(5-bromo-2-methoxyphenyl)methyl]-2-(piperidin-1-yl)-1,3-benzothiazole-6-carboxamide
Chemical Structure Depiction of
N-[(5-bromo-2-methoxyphenyl)methyl]-2-(piperidin-1-yl)-1,3-benzothiazole-6-carboxamide
N-[(5-bromo-2-methoxyphenyl)methyl]-2-(piperidin-1-yl)-1,3-benzothiazole-6-carboxamide
Compound characteristics
| Compound ID: | C797-0322 |
| Compound Name: | N-[(5-bromo-2-methoxyphenyl)methyl]-2-(piperidin-1-yl)-1,3-benzothiazole-6-carboxamide |
| Molecular Weight: | 460.39 |
| Molecular Formula: | C21 H22 Br N3 O2 S |
| Smiles: | COc1ccc(cc1CNC(c1ccc2c(c1)sc(n2)N1CCCCC1)=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 5.3383 |
| logD: | 5.3372 |
| logSw: | -5.2488 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.27 |
| InChI Key: | IDZWWIDKSQLDGH-UHFFFAOYSA-N |