6-ethoxy-4-[4-(propan-2-yl)anilino]quinoline-3-carbonitrile--hydrogen chloride (1/1)
Chemical Structure Depiction of
6-ethoxy-4-[4-(propan-2-yl)anilino]quinoline-3-carbonitrile--hydrogen chloride (1/1)
6-ethoxy-4-[4-(propan-2-yl)anilino]quinoline-3-carbonitrile--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | F360-0959 |
| Compound Name: | 6-ethoxy-4-[4-(propan-2-yl)anilino]quinoline-3-carbonitrile--hydrogen chloride (1/1) |
| Molecular Weight: | 367.88 |
| Molecular Formula: | C21 H21 N3 O |
| Salt: | HCl |
| Smiles: | CCOc1ccc2c(c1)c(c(C#N)cn2)Nc1ccc(cc1)C(C)C |
| Stereo: | ACHIRAL |
| logP: | 5.2173 |
| logD: | 5.2158 |
| logSw: | -5.1864 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.787 |
| InChI Key: | AVVHOWHLPKJQNH-UHFFFAOYSA-N |