2-{3-[2-(3,4-dimethoxyphenyl)ethenyl]-1-phenyl-1H-1,2,4-triazol-5-yl}phenol
Chemical Structure Depiction of
2-{3-[2-(3,4-dimethoxyphenyl)ethenyl]-1-phenyl-1H-1,2,4-triazol-5-yl}phenol
2-{3-[2-(3,4-dimethoxyphenyl)ethenyl]-1-phenyl-1H-1,2,4-triazol-5-yl}phenol
Compound characteristics
| Compound ID: | 5169-1136 |
| Compound Name: | 2-{3-[2-(3,4-dimethoxyphenyl)ethenyl]-1-phenyl-1H-1,2,4-triazol-5-yl}phenol |
| Molecular Weight: | 399.45 |
| Molecular Formula: | C24 H21 N3 O3 |
| Smiles: | COc1ccc(/C=C/c2nc(c3ccccc3O)n(c3ccccc3)n2)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 5.3317 |
| logD: | 5.1481 |
| logSw: | -5.2473 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.417 |
| InChI Key: | NPCBRHWKTKGKNJ-UHFFFAOYSA-N |