[5-(benzylamino)-3-phenyl-1H-1,2,4-triazol-1-yl](3,4-dimethoxyphenyl)methanone
Chemical Structure Depiction of
[5-(benzylamino)-3-phenyl-1H-1,2,4-triazol-1-yl](3,4-dimethoxyphenyl)methanone
[5-(benzylamino)-3-phenyl-1H-1,2,4-triazol-1-yl](3,4-dimethoxyphenyl)methanone
Compound characteristics
| Compound ID: | 6855-0016 |
| Compound Name: | [5-(benzylamino)-3-phenyl-1H-1,2,4-triazol-1-yl](3,4-dimethoxyphenyl)methanone |
| Molecular Weight: | 414.46 |
| Molecular Formula: | C24 H22 N4 O3 |
| Smiles: | COc1ccc(cc1OC)C(n1c(NCc2ccccc2)nc(c2ccccc2)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.922 |
| logD: | 3.922 |
| logSw: | -4.128 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.488 |
| InChI Key: | IWFHPGYTTFGDKL-UHFFFAOYSA-N |