4-acetamido-N-{5-[1-(3,5-dimethylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl}benzamide
Chemical Structure Depiction of
4-acetamido-N-{5-[1-(3,5-dimethylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl}benzamide
4-acetamido-N-{5-[1-(3,5-dimethylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl}benzamide
Compound characteristics
| Compound ID: | D294-1223 |
| Compound Name: | 4-acetamido-N-{5-[1-(3,5-dimethylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl}benzamide |
| Molecular Weight: | 449.53 |
| Molecular Formula: | C23 H23 N5 O3 S |
| Smiles: | CC(Nc1ccc(cc1)C(Nc1nnc(C2CC(N(C2)c2cc(C)cc(C)c2)=O)s1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3578 |
| logD: | 2.2252 |
| logSw: | -3.5303 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.615 |
| InChI Key: | VBDFWHBAFASCIV-KRWDZBQOSA-N |