C46H32N2 — CID 59629341
2-(3,5-diphenylphenyl)-5-[6-(3,5-diphenylphenyl)-3-pyridinyl]pyridine (PubChem CID 59629341) has the molecular formula C46H32N2 and a molecular weight of 612.78 g/mol. Its IUPAC name is 2-(3,5-diphenylphenyl)-5-[6-(3,5-diphenylphenyl)-3-pyridinyl]pyridine.
| Compound Name | 2-(3,5-diphenylphenyl)-5-[6-(3,5-diphenylphenyl)-3-pyridinyl]pyridine |
|---|---|
| PubChem CID | 59629341 |
| Molecular Formula | C46H32N2 |
| Molecular Weight | 612.78 g/mol |
| Exact Mass | 612.26 |
| IUPAC Name | 2-(3,5-diphenylphenyl)-5-[6-(3,5-diphenylphenyl)-3-pyridinyl]pyridine |
| SMILES | c1ccc(-c2cc(-c3ccccc3)cc(-c3ccc(-c4ccc(-c5cc(-c6ccccc6)cc(-c6ccccc6)c5)nc4)cn3)c2)cc1 |
| InChI | InChI=1S/C46H32N2/c1-5-13-33(14-6-1)39-25-40(34-15-7-2-8-16-34)28-43(27-39)45-23-21-37(31-47-45)38-22-24-46(48-32-38)44-29-41(35-17-9-3-10-18-35)26-42(30-44)36-19-11-4-12-20-36/h1-32H |
| InChIKey | DEJGDEAHXBFRBS-UHFFFAOYSA-N |
| XLogP | 12.15 |
| TPSA | 25.78 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Heavy Atoms | 48 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 612.78 |
| LogP ≤ 5 | 12.15 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |