[5-{[(4-fluorophenyl)methyl]amino}-3-(pyridin-3-yl)-1H-1,2,4-triazol-1-yl](3-methoxyphenyl)methanone
Chemical Structure Depiction of
[5-{[(4-fluorophenyl)methyl]amino}-3-(pyridin-3-yl)-1H-1,2,4-triazol-1-yl](3-methoxyphenyl)methanone
[5-{[(4-fluorophenyl)methyl]amino}-3-(pyridin-3-yl)-1H-1,2,4-triazol-1-yl](3-methoxyphenyl)methanone
Compound characteristics
| Compound ID: | D116-0368 |
| Compound Name: | [5-{[(4-fluorophenyl)methyl]amino}-3-(pyridin-3-yl)-1H-1,2,4-triazol-1-yl](3-methoxyphenyl)methanone |
| Molecular Weight: | 403.41 |
| Molecular Formula: | C22 H18 F N5 O2 |
| Smiles: | COc1cccc(c1)C(n1c(NCc2ccc(cc2)F)nc(c2cccnc2)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0135 |
| logD: | 2.8641 |
| logSw: | -3.0875 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.289 |
| InChI Key: | ZCDQILSVGWQXQB-UHFFFAOYSA-N |