4-{[(2-chlorophenyl)methyl]amino}-7-methoxyquinoline-3-carbonitrile--hydrogen chloride (1/1)
Chemical Structure Depiction of
4-{[(2-chlorophenyl)methyl]amino}-7-methoxyquinoline-3-carbonitrile--hydrogen chloride (1/1)
4-{[(2-chlorophenyl)methyl]amino}-7-methoxyquinoline-3-carbonitrile--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | F360-0706 |
| Compound Name: | 4-{[(2-chlorophenyl)methyl]amino}-7-methoxyquinoline-3-carbonitrile--hydrogen chloride (1/1) |
| Molecular Weight: | 360.24 |
| Molecular Formula: | C18 H14 Cl N3 O |
| Salt: | HCl |
| Smiles: | COc1ccc2c(c(C#N)cnc2c1)NCc1ccccc1[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.7912 |
| logD: | 3.7907 |
| logSw: | -4.2849 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.53 |
| InChI Key: | JKGHRKZZCCDMFI-UHFFFAOYSA-N |