N-[(3-bromophenyl)methyl]-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-[(3-bromophenyl)methyl]-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)piperidine-4-carboxamide
N-[(3-bromophenyl)methyl]-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | C797-0226 |
| Compound Name: | N-[(3-bromophenyl)methyl]-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)piperidine-4-carboxamide |
| Molecular Weight: | 458.42 |
| Molecular Formula: | C22 H24 Br N3 O S |
| Smiles: | Cc1cc(C)c2c(c1)sc(n2)N1CCC(CC1)C(NCc1cccc(c1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 5.4644 |
| logD: | 5.4628 |
| logSw: | -5.3162 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.41 |
| InChI Key: | OTCURQZRVWTUHV-UHFFFAOYSA-N |