ethyl N-{4-[5-(phenylcarbamoyl)-1,3,4-thiadiazol-2-yl]piperidine-1-carbonyl}alaninate
Chemical Structure Depiction of
ethyl N-{4-[5-(phenylcarbamoyl)-1,3,4-thiadiazol-2-yl]piperidine-1-carbonyl}alaninate
ethyl N-{4-[5-(phenylcarbamoyl)-1,3,4-thiadiazol-2-yl]piperidine-1-carbonyl}alaninate
Compound characteristics
Compound ID: | L077-0602 |
Compound Name: | ethyl N-{4-[5-(phenylcarbamoyl)-1,3,4-thiadiazol-2-yl]piperidine-1-carbonyl}alaninate |
Molecular Weight: | 431.51 |
Molecular Formula: | C20 H25 N5 O4 S |
Smiles: | CCOC(C(C)NC(N1CCC(CC1)c1nnc(C(Nc2ccccc2)=O)s1)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.4117 |
logD: | 2.4117 |
logSw: | -2.8568 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 93.542 |
InChI Key: | UIPUTHAQOSPCJE-ZDUSSCGKSA-N |