4-{[2-({[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}-2-methoxyphenyl acetate
Chemical Structure Depiction of
4-{[2-({[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}-2-methoxyphenyl acetate
4-{[2-({[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}-2-methoxyphenyl acetate
Compound characteristics
| Compound ID: | 3254-1382 |
| Compound Name: | 4-{[2-({[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}-2-methoxyphenyl acetate |
| Molecular Weight: | 550.04 |
| Molecular Formula: | C27 H24 Cl N5 O4 S |
| Smiles: | CC(=O)Oc1ccc(/C=N/NC(CSc2nnc(c3ccc(cc3)[Cl])n2c2ccc(C)cc2)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 5.3087 |
| logD: | 5.3086 |
| logSw: | -6.1283 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.555 |
| InChI Key: | RGZBOLHPWRTSOR-UHFFFAOYSA-N |