(2-{[2-({[5-(3,4-dimethoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}phenoxy)acetic acid
Chemical Structure Depiction of
(2-{[2-({[5-(3,4-dimethoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}phenoxy)acetic acid
(2-{[2-({[5-(3,4-dimethoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}phenoxy)acetic acid
Compound characteristics
| Compound ID: | 2357-3568 |
| Compound Name: | (2-{[2-({[5-(3,4-dimethoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}phenoxy)acetic acid |
| Molecular Weight: | 547.59 |
| Molecular Formula: | C27 H25 N5 O6 S |
| Smiles: | COc1ccc(cc1OC)c1nnc(n1c1ccccc1)SCC(N/N=C/c1ccccc1OCC(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0005 |
| logD: | -0.2365 |
| logSw: | -4.1889 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 111.317 |
| InChI Key: | IQUJWZJNDSPKTB-UHFFFAOYSA-N |