(2-{[2-({[4-phenyl-5-(3,4,5-trimethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}phenoxy)acetic acid
Chemical Structure Depiction of
(2-{[2-({[4-phenyl-5-(3,4,5-trimethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}phenoxy)acetic acid
(2-{[2-({[4-phenyl-5-(3,4,5-trimethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}phenoxy)acetic acid
Compound characteristics
| Compound ID: | 3254-2503 |
| Compound Name: | (2-{[2-({[4-phenyl-5-(3,4,5-trimethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}phenoxy)acetic acid |
| Molecular Weight: | 577.62 |
| Molecular Formula: | C28 H27 N5 O7 S |
| Smiles: | COc1cc(cc(c1OC)OC)c1nnc(n1c1ccccc1)SCC(N/N=C/c1ccccc1OCC(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8605 |
| logD: | -0.3765 |
| logSw: | -4.0108 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 119.034 |
| InChI Key: | RKVAKYHAHUPLEG-UHFFFAOYSA-N |