1-tert-butyl-5-oxo-N-{5-[(3-phenylpropyl)sulfanyl]-1,3,4-thiadiazol-2-yl}pyrrolidine-3-carboxamide
Chemical Structure Depiction of
1-tert-butyl-5-oxo-N-{5-[(3-phenylpropyl)sulfanyl]-1,3,4-thiadiazol-2-yl}pyrrolidine-3-carboxamide
1-tert-butyl-5-oxo-N-{5-[(3-phenylpropyl)sulfanyl]-1,3,4-thiadiazol-2-yl}pyrrolidine-3-carboxamide
Compound characteristics
| Compound ID: | Y031-4054 |
| Compound Name: | 1-tert-butyl-5-oxo-N-{5-[(3-phenylpropyl)sulfanyl]-1,3,4-thiadiazol-2-yl}pyrrolidine-3-carboxamide |
| Molecular Weight: | 418.58 |
| Molecular Formula: | C20 H26 N4 O2 S2 |
| Smiles: | CC(C)(C)N1CC(CC1=O)C(Nc1nnc(SCCCc2ccccc2)s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2699 |
| logD: | 4.2538 |
| logSw: | -4.2304 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.681 |
| InChI Key: | SJYJMRVDBLTSRV-HNNXBMFYSA-N |