4-(3-chloro-4-fluoroanilino)-6-ethoxyquinoline-3-carbonitrile--hydrogen chloride (1/1)
Chemical Structure Depiction of
4-(3-chloro-4-fluoroanilino)-6-ethoxyquinoline-3-carbonitrile--hydrogen chloride (1/1)
4-(3-chloro-4-fluoroanilino)-6-ethoxyquinoline-3-carbonitrile--hydrogen chloride (1/1)
Compound characteristics
Compound ID: | F360-0901 |
Compound Name: | 4-(3-chloro-4-fluoroanilino)-6-ethoxyquinoline-3-carbonitrile--hydrogen chloride (1/1) |
Molecular Weight: | 378.23 |
Molecular Formula: | C18 H13 Cl F N3 O |
Salt: | HCl |
Smiles: | CCOc1ccc2c(c1)c(c(C#N)cn2)Nc1ccc(c(c1)[Cl])F |
Stereo: | ACHIRAL |
logP: | 4.6092 |
logD: | 4.6077 |
logSw: | -4.805 |
Hydrogen bond acceptors count: | 3 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 40.787 |
InChI Key: | WXQDMBWDCPSXOH-UHFFFAOYSA-N |