HuagongsheHuagongshe Chemistry Print Report · For research reference only
3-Amino-6,7-dimethyl-4-pentyl-2-quinolinecarboxylic acid
Identifiers & Physical Properties
| CAS No. | 65298-49-9 |
|---|---|
| Molecular formula | C17H22N2O2 |
| Average molar mass | 286.37 g/mol |
| Monoisotopic mass | 286.16812795 g/mol |
| SMILES | CCCCCc1c(N)c(C(=O)O)nc2cc(C)c(C)cc12 |
| InChIKey | KQLXMEKJTZJCIC-UHFFFAOYSA-N |
| PubChem CID | 12379998 |
| DTXSID | DTXSID001201677 |
Chemical & Physical Properties
| XLogP | 5.1 |
|---|---|
| Topological polar surface area | 76.2 |
| Hydrogen bond donors | 2 |
| Hydrogen bond acceptors | 4 |
| Rotatable bonds | 5 |
| Heavy atoms | 21 |
| Formal charge | 0 |
| Complexity | 361 |