976
(2S)-2-(6-chloro-2-methyl-4-phenylquinolin-3-yl)pentanoic acid
Find entries where: 976
is present as a standalone ligand in 1 entries
Chemical Component Summary | |
|---|---|
| Name | (2S)-2-(6-chloro-2-methyl-4-phenylquinolin-3-yl)pentanoic acid |
| Identifiers | (2S)-2-(6-chloro-2-methyl-4-phenyl-quinolin-3-yl)pentanoic acid |
| Formula | C21 H20 Cl N O2 |
| Molecular Weight | 353.842 |
| Type | NON-POLYMER |
| Isomeric SMILES | CCC[C@@H](c1c(nc2ccc(cc2c1c3ccccc3)Cl)C)C(=O)O |
| InChI | InChI=1S/C21H20ClNO2/c1-3-7-16(21(24)25)19-13(2)23-18-11-10-15(22)12-17(18)20(19)14-8-5-4-6-9-14/h4-6,8-12,16H,3,7H2,1-2H3,(H,24,25)/t16-/m0/s1 |
| InChIKey | XRPUJSGGRFQZPJ-INIZCTEOSA-N |
Chemical Details | |
|---|---|
| Formal Charge | 0 |
| Atom Count | 45 |
| Chiral Atom Count | 1 |
| Bond Count | 47 |
| Aromatic Bond Count | 18 |
Related Resource References
| Resource Name | Reference |
|---|---|
| PubChem | 45281242 |
| ChEMBL | CHEMBL1230654 |
