N-{5-[1-(3,4-dimethylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl}-4-(2-methylpropanamido)benzamide
Chemical Structure Depiction of
N-{5-[1-(3,4-dimethylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl}-4-(2-methylpropanamido)benzamide
N-{5-[1-(3,4-dimethylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl}-4-(2-methylpropanamido)benzamide
Compound characteristics
| Compound ID: | D294-3092 |
| Compound Name: | N-{5-[1-(3,4-dimethylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl}-4-(2-methylpropanamido)benzamide |
| Molecular Weight: | 477.58 |
| Molecular Formula: | C25 H27 N5 O3 S |
| Smiles: | CC(C)C(Nc1ccc(cc1)C(Nc1nnc(C2CC(N(C2)c2ccc(C)c(C)c2)=O)s1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4495 |
| logD: | 3.3169 |
| logSw: | -4.1802 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.716 |
| InChI Key: | VCLITKBDVAOQMZ-SFHVURJKSA-N |