ethyl 4-{[1-(5-bromo-6-ethoxy-1,3-benzothiazol-2-yl)piperidine-4-carbonyl]amino}benzoate
Chemical Structure Depiction of
ethyl 4-{[1-(5-bromo-6-ethoxy-1,3-benzothiazol-2-yl)piperidine-4-carbonyl]amino}benzoate
ethyl 4-{[1-(5-bromo-6-ethoxy-1,3-benzothiazol-2-yl)piperidine-4-carbonyl]amino}benzoate
Compound characteristics
Compound ID: | C797-0176 |
Compound Name: | ethyl 4-{[1-(5-bromo-6-ethoxy-1,3-benzothiazol-2-yl)piperidine-4-carbonyl]amino}benzoate |
Molecular Weight: | 532.46 |
Molecular Formula: | C24 H26 Br N3 O4 S |
Smiles: | CCOC(c1ccc(cc1)NC(C1CCN(CC1)c1nc2cc(c(cc2s1)OCC)[Br])=O)=O |
Stereo: | ACHIRAL |
logP: | 5.7186 |
logD: | 5.7167 |
logSw: | -5.4317 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 64.281 |
InChI Key: | TZXWRQINEGEDHT-UHFFFAOYSA-N |