1-[5-{[(4-chlorophenyl)methyl]amino}-3-(pyridin-3-yl)-1H-1,2,4-triazol-1-yl]-3-phenylprop-2-en-1-one
Chemical Structure Depiction of
1-[5-{[(4-chlorophenyl)methyl]amino}-3-(pyridin-3-yl)-1H-1,2,4-triazol-1-yl]-3-phenylprop-2-en-1-one
1-[5-{[(4-chlorophenyl)methyl]amino}-3-(pyridin-3-yl)-1H-1,2,4-triazol-1-yl]-3-phenylprop-2-en-1-one
Compound characteristics
| Compound ID: | F019-3101 |
| Compound Name: | 1-[5-{[(4-chlorophenyl)methyl]amino}-3-(pyridin-3-yl)-1H-1,2,4-triazol-1-yl]-3-phenylprop-2-en-1-one |
| Molecular Weight: | 415.88 |
| Molecular Formula: | C23 H18 Cl N5 O |
| Smiles: | C(c1ccc(cc1)[Cl])Nc1nc(c2cccnc2)nn1C(/C=C/c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0521 |
| logD: | 3.9028 |
| logSw: | -4.6139 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.217 |
| InChI Key: | YMVULPJXQDPXQL-JLHYYAGUSA-N |