4-(3-chloro-4-fluoroanilino)-7-methoxyquinoline-3-carbonitrile--hydrogen chloride (1/1)
Chemical Structure Depiction of
4-(3-chloro-4-fluoroanilino)-7-methoxyquinoline-3-carbonitrile--hydrogen chloride (1/1)
4-(3-chloro-4-fluoroanilino)-7-methoxyquinoline-3-carbonitrile--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | F360-0628 |
| Compound Name: | 4-(3-chloro-4-fluoroanilino)-7-methoxyquinoline-3-carbonitrile--hydrogen chloride (1/1) |
| Molecular Weight: | 364.2 |
| Molecular Formula: | C17 H11 Cl F N3 O |
| Salt: | HCl |
| Smiles: | COc1ccc2c(c(C#N)cnc2c1)Nc1ccc(c(c1)[Cl])F |
| Stereo: | ACHIRAL |
| logP: | 4.2395 |
| logD: | 4.2394 |
| logSw: | -4.662 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.208 |
| InChI Key: | DLWYTMANAALSLA-UHFFFAOYSA-N |