ethyl 1-[3-(2-propanamido-1,3-benzothiazol-6-yl)propanoyl]piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-[3-(2-propanamido-1,3-benzothiazol-6-yl)propanoyl]piperidine-4-carboxylate
ethyl 1-[3-(2-propanamido-1,3-benzothiazol-6-yl)propanoyl]piperidine-4-carboxylate
Compound characteristics
Compound ID: | F222-1152 |
Compound Name: | ethyl 1-[3-(2-propanamido-1,3-benzothiazol-6-yl)propanoyl]piperidine-4-carboxylate |
Molecular Weight: | 417.53 |
Molecular Formula: | C21 H27 N3 O4 S |
Smiles: | CCC(Nc1nc2ccc(CCC(N3CCC(CC3)C(=O)OCC)=O)cc2s1)=O |
Stereo: | ACHIRAL |
logP: | 3.0284 |
logD: | 3.0283 |
logSw: | -3.2978 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 70.024 |
InChI Key: | RRBAHRTUCREGNK-UHFFFAOYSA-N |