4-butanamido-N-{5-[1-(3,4-dimethylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl}benzamide
Chemical Structure Depiction of
4-butanamido-N-{5-[1-(3,4-dimethylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl}benzamide
4-butanamido-N-{5-[1-(3,4-dimethylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl}benzamide
Compound characteristics
| Compound ID: | D294-3048 |
| Compound Name: | 4-butanamido-N-{5-[1-(3,4-dimethylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl}benzamide |
| Molecular Weight: | 477.58 |
| Molecular Formula: | C25 H27 N5 O3 S |
| Smiles: | CCCC(Nc1ccc(cc1)C(Nc1nnc(C2CC(N(C2)c2ccc(C)c(C)c2)=O)s1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4645 |
| logD: | 3.3319 |
| logSw: | -4.2156 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.502 |
| InChI Key: | JXYQWKIBDLQOLQ-SFHVURJKSA-N |