[5-{[(3,4-dimethoxyphenyl)methyl]amino}-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl](2-methylphenyl)methanone
Chemical Structure Depiction of
[5-{[(3,4-dimethoxyphenyl)methyl]amino}-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl](2-methylphenyl)methanone
[5-{[(3,4-dimethoxyphenyl)methyl]amino}-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl](2-methylphenyl)methanone
Compound characteristics
| Compound ID: | D331-0193 |
| Compound Name: | [5-{[(3,4-dimethoxyphenyl)methyl]amino}-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl](2-methylphenyl)methanone |
| Molecular Weight: | 418.45 |
| Molecular Formula: | C23 H22 N4 O4 |
| Smiles: | Cc1ccccc1C(n1c(NCc2ccc(c(c2)OC)OC)nc(c2ccco2)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3012 |
| logD: | 3.3012 |
| logSw: | -3.7302 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.066 |
| InChI Key: | XYXFZRWCBYSMOT-UHFFFAOYSA-N |