1-(4-ethoxyphenyl)-5-oxo-N-{5-[(phenylsulfanyl)methyl]-1,3,4-thiadiazol-2-yl}pyrrolidine-3-carboxamide
Chemical Structure Depiction of
1-(4-ethoxyphenyl)-5-oxo-N-{5-[(phenylsulfanyl)methyl]-1,3,4-thiadiazol-2-yl}pyrrolidine-3-carboxamide
1-(4-ethoxyphenyl)-5-oxo-N-{5-[(phenylsulfanyl)methyl]-1,3,4-thiadiazol-2-yl}pyrrolidine-3-carboxamide
Compound characteristics
| Compound ID: | Y031-3659 |
| Compound Name: | 1-(4-ethoxyphenyl)-5-oxo-N-{5-[(phenylsulfanyl)methyl]-1,3,4-thiadiazol-2-yl}pyrrolidine-3-carboxamide |
| Molecular Weight: | 454.57 |
| Molecular Formula: | C22 H22 N4 O3 S2 |
| Smiles: | CCOc1ccc(cc1)N1CC(CC1=O)C(Nc1nnc(CSc2ccccc2)s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6961 |
| logD: | 2.8703 |
| logSw: | -3.6948 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.972 |
| InChI Key: | KZMASJGTXJHQCZ-HNNXBMFYSA-N |