2-{3-[2-(3,4-dimethoxyphenyl)ethenyl]-1-ethyl-1H-1,2,4-triazol-5-yl}phenol
Chemical Structure Depiction of
2-{3-[2-(3,4-dimethoxyphenyl)ethenyl]-1-ethyl-1H-1,2,4-triazol-5-yl}phenol
2-{3-[2-(3,4-dimethoxyphenyl)ethenyl]-1-ethyl-1H-1,2,4-triazol-5-yl}phenol
Compound characteristics
| Compound ID: | 8018-5405 |
| Compound Name: | 2-{3-[2-(3,4-dimethoxyphenyl)ethenyl]-1-ethyl-1H-1,2,4-triazol-5-yl}phenol |
| Molecular Weight: | 351.4 |
| Molecular Formula: | C20 H21 N3 O3 |
| Smiles: | CCn1c(c2ccccc2O)nc(/C=C/c2ccc(c(c2)OC)OC)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.0994 |
| logD: | 4.0902 |
| logSw: | -3.764 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.277 |
| InChI Key: | ZUASXELPEBZKSY-UHFFFAOYSA-N |