C59H39N — CID 118901430
2,6-bis(3-naphthalen-1-ylphenyl)-4-[4-(3-naphthalen-1-ylphenyl)phenyl]pyridine (PubChem CID 118901430) has the molecular formula C59H39N and a molecular weight of 761.97 g/mol. Its IUPAC name is 2,6-bis(3-naphthalen-1-ylphenyl)-4-[4-(3-naphthalen-1-ylphenyl)phenyl]pyridine.
| Compound Name | 2,6-bis(3-naphthalen-1-ylphenyl)-4-[4-(3-naphthalen-1-ylphenyl)phenyl]pyridine |
|---|---|
| PubChem CID | 118901430 |
| Molecular Formula | C59H39N |
| Molecular Weight | 761.97 g/mol |
| Exact Mass | 761.31 |
| IUPAC Name | 2,6-bis(3-naphthalen-1-ylphenyl)-4-[4-(3-naphthalen-1-ylphenyl)phenyl]pyridine |
| SMILES | c1cc(-c2ccc(-c3cc(-c4cccc(-c5cccc6ccccc56)c4)nc(-c4cccc(-c5cccc6ccccc56)c4)c3)cc2)cc(-c2cccc3ccccc23)c1 |
| InChI | InChI=1S/C59H39N/c1-4-25-52-42(13-1)16-10-28-55(52)46-20-7-19-45(35-46)40-31-33-41(34-32-40)51-38-58(49-23-8-21-47(36-49)56-29-11-17-43-14-2-5-26-53(43)56)60-59(39-51)50-24-9-22-48(37-50)57-30-12-18-44-15-3-6-27-54(44)57/h1-39H |
| InChIKey | FZZVUWFQKPHKQD-UHFFFAOYSA-N |
| XLogP | 16.21 |
| TPSA | 12.89 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 7 |
| Heavy Atoms | 60 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 761.97 |
| LogP ≤ 5 | 16.21 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |