1-methyl-3-{[2-(3,4,6-trichloro-5-cyanopyridin-2-yl)hydrazinylidene]methyl}pyridin-1-ium--iodide (1/1)
Chemical Structure Depiction of
1-methyl-3-{[2-(3,4,6-trichloro-5-cyanopyridin-2-yl)hydrazinylidene]methyl}pyridin-1-ium--iodide (1/1)
1-methyl-3-{[2-(3,4,6-trichloro-5-cyanopyridin-2-yl)hydrazinylidene]methyl}pyridin-1-ium--iodide (1/1)
Compound characteristics
Compound ID: | 8005-8393 |
Compound Name: | 1-methyl-3-{[2-(3,4,6-trichloro-5-cyanopyridin-2-yl)hydrazinylidene]methyl}pyridin-1-ium--iodide (1/1) |
Molecular Weight: | 468.51 |
Molecular Formula: | C13 H9 Cl3 N5 |
Salt: | I- |
Smiles: | C[n+]1cccc(/C=N/Nc2c(c(c(C#N)c(n2)[Cl])[Cl])[Cl])c1 |
Stereo: | ACHIRAL |
logP: | 3.5294 |
logD: | 3.0914 |
logSw: | -5.2387 |
Hydrogen bond acceptors count: | 3 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 51.583 |
InChI Key: | PLJPATNATLIKFV-NGYBGAFCSA-N |