[5-(benzylamino)-3-(pyridin-3-yl)-1H-1,2,4-triazol-1-yl](3,4,5-trimethoxyphenyl)methanone
Chemical Structure Depiction of
[5-(benzylamino)-3-(pyridin-3-yl)-1H-1,2,4-triazol-1-yl](3,4,5-trimethoxyphenyl)methanone
[5-(benzylamino)-3-(pyridin-3-yl)-1H-1,2,4-triazol-1-yl](3,4,5-trimethoxyphenyl)methanone
Compound characteristics
| Compound ID: | D116-0285 |
| Compound Name: | [5-(benzylamino)-3-(pyridin-3-yl)-1H-1,2,4-triazol-1-yl](3,4,5-trimethoxyphenyl)methanone |
| Molecular Weight: | 445.48 |
| Molecular Formula: | C24 H23 N5 O4 |
| Smiles: | COc1cc(cc(c1OC)OC)C(n1c(NCc2ccccc2)nc(c2cccnc2)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7214 |
| logD: | 2.572 |
| logSw: | -3.1035 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.723 |
| InChI Key: | FNBKUANKVZFPTE-UHFFFAOYSA-N |