4-(3,4,5-trimethoxyanilino)quinoline-3-carbonitrile--hydrogen chloride (1/1)
Chemical Structure Depiction of
4-(3,4,5-trimethoxyanilino)quinoline-3-carbonitrile--hydrogen chloride (1/1)
4-(3,4,5-trimethoxyanilino)quinoline-3-carbonitrile--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | F360-0042 |
| Compound Name: | 4-(3,4,5-trimethoxyanilino)quinoline-3-carbonitrile--hydrogen chloride (1/1) |
| Molecular Weight: | 371.82 |
| Molecular Formula: | C19 H17 N3 O3 |
| Salt: | HCl |
| Smiles: | COc1cc(cc(c1OC)OC)Nc1c(C#N)cnc2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 2.7322 |
| logD: | 2.7321 |
| logSw: | -3.1796 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.642 |
| InChI Key: | ZKUBRAUNASVGJB-UHFFFAOYSA-N |