5-[3-(4-bromo-3-methylanilino)-3-oxopropyl]-N-(4-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-[3-(4-bromo-3-methylanilino)-3-oxopropyl]-N-(4-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide
5-[3-(4-bromo-3-methylanilino)-3-oxopropyl]-N-(4-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | G713-0291 |
| Compound Name: | 5-[3-(4-bromo-3-methylanilino)-3-oxopropyl]-N-(4-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 463.33 |
| Molecular Formula: | C19 H16 Br F N4 O2 S |
| Smiles: | Cc1cc(ccc1[Br])NC(CCc1nnc(C(Nc2ccc(cc2)F)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1208 |
| logD: | 4.1181 |
| logSw: | -4.2189 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.207 |
| InChI Key: | YKMPYJVNQLIFRO-UHFFFAOYSA-N |