5-[1-(4-bromobenzoyl)pyrrolidin-2-yl]-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-[1-(4-bromobenzoyl)pyrrolidin-2-yl]-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
5-[1-(4-bromobenzoyl)pyrrolidin-2-yl]-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F792-0547 |
| Compound Name: | 5-[1-(4-bromobenzoyl)pyrrolidin-2-yl]-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 471.37 |
| Molecular Formula: | C21 H19 Br N4 O2 S |
| Smiles: | Cc1ccc(cc1)NC(c1nnc(C2CCCN2C(c2ccc(cc2)[Br])=O)s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2503 |
| logD: | 4.2502 |
| logSw: | -4.0663 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.27 |
| InChI Key: | LYPVTMAVPAFHFE-KRWDZBQOSA-N |