2,3,5-trichloro-6-(1,4-diazepan-1-yl)pyridine-4-carbonitrile--hydrogen chloride (1/1)
Chemical Structure Depiction of
2,3,5-trichloro-6-(1,4-diazepan-1-yl)pyridine-4-carbonitrile--hydrogen chloride (1/1)
2,3,5-trichloro-6-(1,4-diazepan-1-yl)pyridine-4-carbonitrile--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 8012-7514 |
| Compound Name: | 2,3,5-trichloro-6-(1,4-diazepan-1-yl)pyridine-4-carbonitrile--hydrogen chloride (1/1) |
| Molecular Weight: | 342.05 |
| Molecular Formula: | C11 H11 Cl3 N4 |
| Salt: | HCl |
| Smiles: | C1CNCCN(C1)c1c(c(C#N)c(c(n1)[Cl])[Cl])[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.5136 |
| logD: | 1.4369 |
| logSw: | -3.9446 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.225 |
| InChI Key: | HOPCRPJOSCCCFJ-UHFFFAOYSA-N |