1-(3-chlorophenyl)-N-(4-fluorophenyl)-5-(4-methoxyphenyl)-1H-1,2,4-triazole-3-carboxamide
Chemical Structure Depiction of
1-(3-chlorophenyl)-N-(4-fluorophenyl)-5-(4-methoxyphenyl)-1H-1,2,4-triazole-3-carboxamide
1-(3-chlorophenyl)-N-(4-fluorophenyl)-5-(4-methoxyphenyl)-1H-1,2,4-triazole-3-carboxamide
Compound characteristics
| Compound ID: | D351-2764 |
| Compound Name: | 1-(3-chlorophenyl)-N-(4-fluorophenyl)-5-(4-methoxyphenyl)-1H-1,2,4-triazole-3-carboxamide |
| Molecular Weight: | 422.84 |
| Molecular Formula: | C22 H16 Cl F N4 O2 |
| Smiles: | COc1ccc(cc1)c1nc(C(Nc2ccc(cc2)F)=O)nn1c1cccc(c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.4889 |
| logD: | 5.4887 |
| logSw: | -6.0508 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.524 |
| InChI Key: | SSWITHACSHYYNS-UHFFFAOYSA-N |