5-[3-(2-chloro-4,6-dimethoxyanilino)-3-oxopropyl]-N-(4-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-[3-(2-chloro-4,6-dimethoxyanilino)-3-oxopropyl]-N-(4-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide
5-[3-(2-chloro-4,6-dimethoxyanilino)-3-oxopropyl]-N-(4-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | G713-0315 |
| Compound Name: | 5-[3-(2-chloro-4,6-dimethoxyanilino)-3-oxopropyl]-N-(4-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 464.9 |
| Molecular Formula: | C20 H18 Cl F N4 O4 S |
| Smiles: | COc1cc(c(c(c1)[Cl])NC(CCc1nnc(C(Nc2ccc(cc2)F)=O)s1)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.9157 |
| logD: | 2.901 |
| logSw: | -3.5708 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.985 |
| InChI Key: | VMWKQVRTKXPZFI-UHFFFAOYSA-N |