4-(3-chloro-4-methoxyanilino)-6,7-dimethoxyquinoline-3-carbonitrile--hydrogen chloride (1/1)
Chemical Structure Depiction of
4-(3-chloro-4-methoxyanilino)-6,7-dimethoxyquinoline-3-carbonitrile--hydrogen chloride (1/1)
4-(3-chloro-4-methoxyanilino)-6,7-dimethoxyquinoline-3-carbonitrile--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | F360-0189 |
| Compound Name: | 4-(3-chloro-4-methoxyanilino)-6,7-dimethoxyquinoline-3-carbonitrile--hydrogen chloride (1/1) |
| Molecular Weight: | 406.27 |
| Molecular Formula: | C19 H16 Cl N3 O3 |
| Salt: | HCl |
| Smiles: | COc1cc2c(c(C#N)cnc2cc1OC)Nc1ccc(c(c1)[Cl])OC |
| Stereo: | ACHIRAL |
| logP: | 3.4398 |
| logD: | 3.437 |
| logSw: | -3.8588 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.555 |
| InChI Key: | OTTMSKLASSZGJD-UHFFFAOYSA-N |