7-methoxy-4-[3-(trifluoromethyl)anilino]quinoline-3-carbonitrile--hydrogen chloride (1/1)
Chemical Structure Depiction of
7-methoxy-4-[3-(trifluoromethyl)anilino]quinoline-3-carbonitrile--hydrogen chloride (1/1)
7-methoxy-4-[3-(trifluoromethyl)anilino]quinoline-3-carbonitrile--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | F360-0638 |
| Compound Name: | 7-methoxy-4-[3-(trifluoromethyl)anilino]quinoline-3-carbonitrile--hydrogen chloride (1/1) |
| Molecular Weight: | 379.77 |
| Molecular Formula: | C18 H12 F3 N3 O |
| Salt: | HCl |
| Smiles: | COc1ccc2c(c(C#N)cnc2c1)Nc1cccc(c1)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 4.5526 |
| logD: | 4.5525 |
| logSw: | -4.5357 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.208 |
| InChI Key: | FSUOHCSQTZCISR-UHFFFAOYSA-N |