(3,4-dimethoxyphenyl)(5-{[(4-methoxyphenyl)methyl]amino}-3-phenyl-1H-1,2,4-triazol-1-yl)methanone
Chemical Structure Depiction of
(3,4-dimethoxyphenyl)(5-{[(4-methoxyphenyl)methyl]amino}-3-phenyl-1H-1,2,4-triazol-1-yl)methanone
(3,4-dimethoxyphenyl)(5-{[(4-methoxyphenyl)methyl]amino}-3-phenyl-1H-1,2,4-triazol-1-yl)methanone
Compound characteristics
| Compound ID: | 6855-0124 |
| Compound Name: | (3,4-dimethoxyphenyl)(5-{[(4-methoxyphenyl)methyl]amino}-3-phenyl-1H-1,2,4-triazol-1-yl)methanone |
| Molecular Weight: | 444.49 |
| Molecular Formula: | C25 H24 N4 O4 |
| Smiles: | COc1ccc(CNc2nc(c3ccccc3)nn2C(c2ccc(c(c2)OC)OC)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.9044 |
| logD: | 3.9044 |
| logSw: | -4.1236 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.032 |
| InChI Key: | ZQNYLHNEPGDJAM-UHFFFAOYSA-N |