(2-{[2-({[5-(4-bromophenyl)-4-(2-methylprop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}phenoxy)acetic acid
Chemical Structure Depiction of
(2-{[2-({[5-(4-bromophenyl)-4-(2-methylprop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}phenoxy)acetic acid
(2-{[2-({[5-(4-bromophenyl)-4-(2-methylprop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}phenoxy)acetic acid
Compound characteristics
| Compound ID: | 2357-3313 |
| Compound Name: | (2-{[2-({[5-(4-bromophenyl)-4-(2-methylprop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}phenoxy)acetic acid |
| Molecular Weight: | 544.43 |
| Molecular Formula: | C23 H22 Br N5 O4 S |
| Smiles: | CC(=C)Cn1c(c2ccc(cc2)[Br])nnc1SCC(N/N=C/c1ccccc1OCC(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1656 |
| logD: | 0.9287 |
| logSw: | -4.9308 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 95.584 |
| InChI Key: | YYANKMOIHCSMMB-UHFFFAOYSA-N |