ethyl 4-[(3-cyano-6-ethylquinolin-4-yl)amino]benzoate--hydrogen chloride (1/1)
Chemical Structure Depiction of
ethyl 4-[(3-cyano-6-ethylquinolin-4-yl)amino]benzoate--hydrogen chloride (1/1)
ethyl 4-[(3-cyano-6-ethylquinolin-4-yl)amino]benzoate--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | F360-0821 |
| Compound Name: | ethyl 4-[(3-cyano-6-ethylquinolin-4-yl)amino]benzoate--hydrogen chloride (1/1) |
| Molecular Weight: | 381.86 |
| Molecular Formula: | C21 H19 N3 O2 |
| Salt: | HCl |
| Smiles: | CCc1ccc2c(c1)c(c(C#N)cn2)Nc1ccc(cc1)C(=O)OCC |
| Stereo: | ACHIRAL |
| logP: | 4.9044 |
| logD: | 4.9041 |
| logSw: | -4.5118 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.418 |
| InChI Key: | ZFNCHIBEMWCILA-UHFFFAOYSA-N |