6-chloro-4-(3-fluoroanilino)quinoline-3-carbonitrile--hydrogen chloride (1/1)
Chemical Structure Depiction of
6-chloro-4-(3-fluoroanilino)quinoline-3-carbonitrile--hydrogen chloride (1/1)
6-chloro-4-(3-fluoroanilino)quinoline-3-carbonitrile--hydrogen chloride (1/1)
Compound characteristics
Compound ID: | F360-0359 |
Compound Name: | 6-chloro-4-(3-fluoroanilino)quinoline-3-carbonitrile--hydrogen chloride (1/1) |
Molecular Weight: | 334.18 |
Molecular Formula: | C16 H9 Cl F N3 |
Salt: | HCl |
Smiles: | C(c1cnc2ccc(cc2c1Nc1cccc(c1)F)[Cl])#N |
Stereo: | ACHIRAL |
logP: | 4.297 |
logD: | 4.297 |
logSw: | -4.6795 |
Hydrogen bond acceptors count: | 2 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 33.664 |
InChI Key: | RRHJLXNDSYCJPS-UHFFFAOYSA-N |