3-(4-chlorophenyl)-1-phenyl-N-(4H-1,2,4-triazol-3-yl)-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
3-(4-chlorophenyl)-1-phenyl-N-(4H-1,2,4-triazol-3-yl)-1H-pyrazole-5-carboxamide
3-(4-chlorophenyl)-1-phenyl-N-(4H-1,2,4-triazol-3-yl)-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | Y044-1848 |
| Compound Name: | 3-(4-chlorophenyl)-1-phenyl-N-(4H-1,2,4-triazol-3-yl)-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 364.79 |
| Molecular Formula: | C18 H13 Cl N6 O |
| Smiles: | c1ccc(cc1)n1c(cc(c2ccc(cc2)[Cl])n1)C(Nc1nnc[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8369 |
| logD: | 2.8306 |
| logSw: | -3.6858 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.99 |
| InChI Key: | KHNDRFDCQZFBKR-UHFFFAOYSA-N |