1-(5-bromo-6-ethoxy-1,3-benzothiazol-2-yl)-N-(2,5-dimethylphenyl)piperidine-4-carboxamide
Chemical Structure Depiction of
1-(5-bromo-6-ethoxy-1,3-benzothiazol-2-yl)-N-(2,5-dimethylphenyl)piperidine-4-carboxamide
1-(5-bromo-6-ethoxy-1,3-benzothiazol-2-yl)-N-(2,5-dimethylphenyl)piperidine-4-carboxamide
Compound characteristics
Compound ID: | C797-0174 |
Compound Name: | 1-(5-bromo-6-ethoxy-1,3-benzothiazol-2-yl)-N-(2,5-dimethylphenyl)piperidine-4-carboxamide |
Molecular Weight: | 488.45 |
Molecular Formula: | C23 H26 Br N3 O2 S |
Smiles: | CCOc1cc2c(cc1[Br])nc(N1CCC(CC1)C(Nc1cc(C)ccc1C)=O)s2 |
Stereo: | ACHIRAL |
logP: | 5.457 |
logD: | 5.4555 |
logSw: | -5.2272 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 42.83 |
InChI Key: | VQMIBBBPGRCXKO-UHFFFAOYSA-N |