4-(4-chloro-2-methoxy-5-methylanilino)quinoline-3-carbonitrile--hydrogen chloride (1/1)
Chemical Structure Depiction of
4-(4-chloro-2-methoxy-5-methylanilino)quinoline-3-carbonitrile--hydrogen chloride (1/1)
4-(4-chloro-2-methoxy-5-methylanilino)quinoline-3-carbonitrile--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | F360-0062 |
| Compound Name: | 4-(4-chloro-2-methoxy-5-methylanilino)quinoline-3-carbonitrile--hydrogen chloride (1/1) |
| Molecular Weight: | 360.24 |
| Molecular Formula: | C18 H14 Cl N3 O |
| Salt: | HCl |
| Smiles: | Cc1cc(c(cc1[Cl])OC)Nc1c(C#N)cnc2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 4.7403 |
| logD: | 4.7403 |
| logSw: | -4.9745 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.597 |
| InChI Key: | MBPAXMGDPNKRQF-UHFFFAOYSA-N |