2-{[2-(4-chloro-1-methyl-1H-pyrazole-5-carbonyl)hydrazinylidene]methyl}phenyl benzenesulfonate
Chemical Structure Depiction of
2-{[2-(4-chloro-1-methyl-1H-pyrazole-5-carbonyl)hydrazinylidene]methyl}phenyl benzenesulfonate
2-{[2-(4-chloro-1-methyl-1H-pyrazole-5-carbonyl)hydrazinylidene]methyl}phenyl benzenesulfonate
Compound characteristics
| Compound ID: | Y508-8168 |
| Compound Name: | 2-{[2-(4-chloro-1-methyl-1H-pyrazole-5-carbonyl)hydrazinylidene]methyl}phenyl benzenesulfonate |
| Molecular Weight: | 418.86 |
| Molecular Formula: | C18 H15 Cl N4 O4 S |
| Smiles: | Cn1c(C(N/N=C/c2ccccc2OS(c2ccccc2)(=O)=O)=O)c(cn1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.9256 |
| logD: | 2.6637 |
| logSw: | -3.5656 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.918 |
| InChI Key: | MPFJZXRREBCBOX-UHFFFAOYSA-N |