6-chloro-4-{[(2-methoxyphenyl)methyl]amino}quinoline-3-carbonitrile--hydrogen chloride (1/1)
Chemical Structure Depiction of
6-chloro-4-{[(2-methoxyphenyl)methyl]amino}quinoline-3-carbonitrile--hydrogen chloride (1/1)
6-chloro-4-{[(2-methoxyphenyl)methyl]amino}quinoline-3-carbonitrile--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | F360-0435 |
| Compound Name: | 6-chloro-4-{[(2-methoxyphenyl)methyl]amino}quinoline-3-carbonitrile--hydrogen chloride (1/1) |
| Molecular Weight: | 360.24 |
| Molecular Formula: | C18 H14 Cl N3 O |
| Salt: | HCl |
| Smiles: | COc1ccccc1CNc1c(C#N)cnc2ccc(cc12)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.8648 |
| logD: | 3.8645 |
| logSw: | -4.3317 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.616 |
| InChI Key: | QWZDKSDLRDFIGD-UHFFFAOYSA-N |