ethyl 4-[(3-cyano-6-methylquinolin-4-yl)amino]benzoate--hydrogen chloride (1/1)
Chemical Structure Depiction of
ethyl 4-[(3-cyano-6-methylquinolin-4-yl)amino]benzoate--hydrogen chloride (1/1)
ethyl 4-[(3-cyano-6-methylquinolin-4-yl)amino]benzoate--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | F360-0102 |
| Compound Name: | ethyl 4-[(3-cyano-6-methylquinolin-4-yl)amino]benzoate--hydrogen chloride (1/1) |
| Molecular Weight: | 367.83 |
| Molecular Formula: | C20 H17 N3 O2 |
| Salt: | HCl |
| Smiles: | CCOC(c1ccc(cc1)Nc1c(C#N)cnc2ccc(C)cc12)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5227 |
| logD: | 4.5225 |
| logSw: | -4.0656 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.418 |
| InChI Key: | BLHZTGAHDBKJNM-UHFFFAOYSA-N |