C18H11BrN4 — CID 139327749
3-(3-bromophenyl)-2-pyridin-3-ylpyrido[2,3-b]pyrazine (PubChem CID 139327749) has the molecular formula C18H11BrN4 and a molecular weight of 363.22 g/mol. Its IUPAC name is 3-(3-bromophenyl)-2-pyridin-3-ylpyrido[2,3-b]pyrazine.
| Compound Name | 3-(3-bromophenyl)-2-pyridin-3-ylpyrido[2,3-b]pyrazine |
|---|---|
| PubChem CID | 139327749 |
| Molecular Formula | C18H11BrN4 |
| Molecular Weight | 363.22 g/mol |
| Exact Mass | 362.02 |
| IUPAC Name | 3-(3-bromophenyl)-2-pyridin-3-ylpyrido[2,3-b]pyrazine |
| SMILES | Brc1cccc(-c2nc3ncccc3nc2-c2cccnc2)c1 |
| InChI | InChI=1S/C18H11BrN4/c19-14-6-1-4-12(10-14)16-17(13-5-2-8-20-11-13)22-15-7-3-9-21-18(15)23-16/h1-11H |
| InChIKey | QZTWKWVYVAFELE-UHFFFAOYSA-N |
| XLogP | 4.52 |
| TPSA | 51.56 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 23 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 363.22 |
| LogP ≤ 5 | 4.52 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 4 |