4-(3-methoxyanilino)quinoline-3-carbonitrile--hydrogen chloride (1/1)
Chemical Structure Depiction of
4-(3-methoxyanilino)quinoline-3-carbonitrile--hydrogen chloride (1/1)
4-(3-methoxyanilino)quinoline-3-carbonitrile--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | F360-0046 |
| Compound Name: | 4-(3-methoxyanilino)quinoline-3-carbonitrile--hydrogen chloride (1/1) |
| Molecular Weight: | 311.77 |
| Molecular Formula: | C17 H13 N3 O |
| Salt: | HCl |
| Smiles: | COc1cccc(c1)Nc1c(C#N)cnc2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 3.418 |
| logD: | 3.418 |
| logSw: | -3.7453 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.208 |
| InChI Key: | MBSRXVGSYMFRBX-UHFFFAOYSA-N |