C21H13BrN4 — CID 68603193
8-bromo-2-(7-pyridin-3-ylimidazo[1,2-a]pyridin-3-yl)quinoline (PubChem CID 68603193) has the molecular formula C21H13BrN4 and a molecular weight of 401.27 g/mol. Its IUPAC name is 8-bromo-2-(7-pyridin-3-ylimidazo[1,2-a]pyridin-3-yl)quinoline.
| Compound Name | 8-bromo-2-(7-pyridin-3-ylimidazo[1,2-a]pyridin-3-yl)quinoline |
|---|---|
| PubChem CID | 68603193 |
| Molecular Formula | C21H13BrN4 |
| Molecular Weight | 401.27 g/mol |
| Exact Mass | 400.03 |
| IUPAC Name | 8-bromo-2-(7-pyridin-3-ylimidazo[1,2-a]pyridin-3-yl)quinoline |
| SMILES | Brc1cccc2ccc(-c3cnc4cc(-c5cccnc5)ccn34)nc12 |
| InChI | InChI=1S/C21H13BrN4/c22-17-5-1-3-14-6-7-18(25-21(14)17)19-13-24-20-11-15(8-10-26(19)20)16-4-2-9-23-12-16/h1-13H |
| InChIKey | ICPGCZYRDWYJST-UHFFFAOYSA-N |
| XLogP | 5.37 |
| TPSA | 43.08 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 26 |
| Complexity | — |
1 violation
| Rule | Value |
|---|---|
| MW ≤ 500 | 401.27 |
| LogP ≤ 5 | 5.37 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 4 |