N-(4-fluorophenyl)-5-({[3-(trifluoromethyl)phenyl]carbamamido}methyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(4-fluorophenyl)-5-({[3-(trifluoromethyl)phenyl]carbamamido}methyl)-1,3,4-thiadiazole-2-carboxamide
N-(4-fluorophenyl)-5-({[3-(trifluoromethyl)phenyl]carbamamido}methyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | L062-0056 |
| Compound Name: | N-(4-fluorophenyl)-5-({[3-(trifluoromethyl)phenyl]carbamamido}methyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 439.39 |
| Molecular Formula: | C18 H13 F4 N5 O2 S |
| Smiles: | C(c1nnc(C(Nc2ccc(cc2)F)=O)s1)NC(Nc1cccc(c1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9285 |
| logD: | 3.9258 |
| logSw: | -4.1876 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 80.954 |
| InChI Key: | BPEJLTQMSOCLKI-UHFFFAOYSA-N |