N-[(5-bromo-2-methoxyphenyl)methyl]-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-[(5-bromo-2-methoxyphenyl)methyl]-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)piperidine-4-carboxamide
N-[(5-bromo-2-methoxyphenyl)methyl]-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | C797-0234 |
| Compound Name: | N-[(5-bromo-2-methoxyphenyl)methyl]-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)piperidine-4-carboxamide |
| Molecular Weight: | 488.45 |
| Molecular Formula: | C23 H26 Br N3 O2 S |
| Smiles: | Cc1cc(C)c2c(c1)sc(n2)N1CCC(CC1)C(NCc1cc(ccc1OC)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 5.6048 |
| logD: | 5.6033 |
| logSw: | -5.3512 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.041 |
| InChI Key: | ITDDUZGFAXSQHD-UHFFFAOYSA-N |