N-{5-[1-(3,5-dimethylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl}-4-propanamidobenzamide
Chemical Structure Depiction of
N-{5-[1-(3,5-dimethylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl}-4-propanamidobenzamide
N-{5-[1-(3,5-dimethylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl}-4-propanamidobenzamide
Compound characteristics
| Compound ID: | D294-3533 |
| Compound Name: | N-{5-[1-(3,5-dimethylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl}-4-propanamidobenzamide |
| Molecular Weight: | 463.56 |
| Molecular Formula: | C24 H25 N5 O3 S |
| Smiles: | CCC(Nc1ccc(cc1)C(Nc1nnc(C2CC(N(C2)c2cc(C)cc(C)c2)=O)s1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8657 |
| logD: | 2.733 |
| logSw: | -3.9375 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.502 |
| InChI Key: | MPFLIGUSXKYXIH-KRWDZBQOSA-N |