[5-{[(3-chlorophenyl)methyl]amino}-3-(pyridin-3-yl)-1H-1,2,4-triazol-1-yl](3-methylphenyl)methanone
Chemical Structure Depiction of
[5-{[(3-chlorophenyl)methyl]amino}-3-(pyridin-3-yl)-1H-1,2,4-triazol-1-yl](3-methylphenyl)methanone
[5-{[(3-chlorophenyl)methyl]amino}-3-(pyridin-3-yl)-1H-1,2,4-triazol-1-yl](3-methylphenyl)methanone
Compound characteristics
| Compound ID: | F019-2772 |
| Compound Name: | [5-{[(3-chlorophenyl)methyl]amino}-3-(pyridin-3-yl)-1H-1,2,4-triazol-1-yl](3-methylphenyl)methanone |
| Molecular Weight: | 403.87 |
| Molecular Formula: | C22 H18 Cl N5 O |
| Smiles: | Cc1cccc(c1)C(n1c(NCc2cccc(c2)[Cl])nc(c2cccnc2)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9907 |
| logD: | 3.8413 |
| logSw: | -4.2286 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.745 |
| InChI Key: | KFTKGOJLWMMKOH-UHFFFAOYSA-N |