3-bromo-N-{5-[1-(2-methylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl}benzamide
Chemical Structure Depiction of
3-bromo-N-{5-[1-(2-methylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl}benzamide
3-bromo-N-{5-[1-(2-methylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl}benzamide
Compound characteristics
| Compound ID: | D294-0861 |
| Compound Name: | 3-bromo-N-{5-[1-(2-methylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl}benzamide |
| Molecular Weight: | 457.35 |
| Molecular Formula: | C20 H17 Br N4 O2 S |
| Smiles: | Cc1ccccc1N1CC(CC1=O)c1nnc(NC(c2cccc(c2)[Br])=O)s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4018 |
| logD: | 2.5971 |
| logSw: | -4.2602 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.052 |
| InChI Key: | PVTHFBCWWZXHIH-AWEZNQCLSA-N |