4-(3-chloro-4-fluoroanilino)-6-ethylquinoline-3-carbonitrile--hydrogen chloride (1/1)
Chemical Structure Depiction of
4-(3-chloro-4-fluoroanilino)-6-ethylquinoline-3-carbonitrile--hydrogen chloride (1/1)
4-(3-chloro-4-fluoroanilino)-6-ethylquinoline-3-carbonitrile--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | F360-0810 |
| Compound Name: | 4-(3-chloro-4-fluoroanilino)-6-ethylquinoline-3-carbonitrile--hydrogen chloride (1/1) |
| Molecular Weight: | 362.23 |
| Molecular Formula: | C18 H13 Cl F N3 |
| Salt: | HCl |
| Smiles: | CCc1ccc2c(c1)c(c(C#N)cn2)Nc1ccc(c(c1)[Cl])F |
| Stereo: | ACHIRAL |
| logP: | 5.0331 |
| logD: | 5.0328 |
| logSw: | -5.3478 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 33.664 |
| InChI Key: | VACKDMPTFBEQJO-UHFFFAOYSA-N |