4-{[(3,4-dimethoxyphenyl)methyl]amino}-6-ethoxyquinoline-3-carbonitrile--hydrogen chloride (1/1)
Chemical Structure Depiction of
4-{[(3,4-dimethoxyphenyl)methyl]amino}-6-ethoxyquinoline-3-carbonitrile--hydrogen chloride (1/1)
4-{[(3,4-dimethoxyphenyl)methyl]amino}-6-ethoxyquinoline-3-carbonitrile--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | F360-0987 |
| Compound Name: | 4-{[(3,4-dimethoxyphenyl)methyl]amino}-6-ethoxyquinoline-3-carbonitrile--hydrogen chloride (1/1) |
| Molecular Weight: | 399.88 |
| Molecular Formula: | C21 H21 N3 O3 |
| Salt: | HCl |
| Smiles: | CCOc1ccc2c(c1)c(c(C#N)cn2)NCc1ccc(c(c1)OC)OC |
| Stereo: | ACHIRAL |
| logP: | 2.9938 |
| logD: | 2.9832 |
| logSw: | -3.2121 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.37 |
| InChI Key: | IAXVEQAOXVGVQQ-UHFFFAOYSA-N |