C165H107N9O3 — CID 160534670
2,4-diphenyl-6-[4-[8-[2-(4-phenylphenyl)phenyl]dibenzofuran-1-yl]phenyl]-1,3,5-triazine;2-phenyl-4-(4-phenylphenyl)-6-[8-[2-phenyl-3-(3-phenylphenyl)phenyl]dibenzofuran-1-yl]-1,3,5-triazine;2-phenyl-4-(4-phenylphenyl)-6-[8-[3-phenyl-5-(3-phenylphenyl)phenyl]dibenzofuran-1-yl]-1,3,5-triazine (PubChem CID 160534670) has the molecular formula C165H107N9O3 and a molecular weight of 2263.73 g/mol. Its IUPAC name is 2,4-diphenyl-6-[4-[8-[2-(4-phenylphenyl)phenyl]dibenzofuran-1-yl]phenyl]-1,3,5-triazine;2-phenyl-4-(4-phenylphenyl)-6-[8-[2-phenyl-3-(3-phenylphenyl)phenyl]dibenzofuran-1-yl]-1,3,5-triazine;2-phenyl-4-(4-phenylphenyl)-6-[8-[3-phenyl-5-(3-phenylphenyl)phenyl]dibenzofuran-1-yl]-1,3,5-triazine.
| Compound Name | 2,4-diphenyl-6-[4-[8-[2-(4-phenylphenyl)phenyl]dibenzofuran-1-yl]phenyl]-1,3,5-triazine;2-phenyl-4-(4-phenylphenyl)-6-[8-[2-phenyl-3-(3-phenylphenyl)phenyl]dibenzofuran-1-yl]-1,3,5-triazine;2-phenyl-4-(4-phenylphenyl)-6-[8-[3-phenyl-5-(3-phenylphenyl)phenyl]dibenzofuran-1-yl]-1,3,5-triazine |
|---|---|
| PubChem CID | 160534670 |
| Molecular Formula | C165H107N9O3 |
| Molecular Weight | 2263.73 g/mol |
| Exact Mass | 2261.85 |
| IUPAC Name | 2,4-diphenyl-6-[4-[8-[2-(4-phenylphenyl)phenyl]dibenzofuran-1-yl]phenyl]-1,3,5-triazine;2-phenyl-4-(4-phenylphenyl)-6-[8-[2-phenyl-3-(3-phenylphenyl)phenyl]dibenzofuran-1-yl]-1,3,5-triazine;2-phenyl-4-(4-phenylphenyl)-6-[8-[3-phenyl-5-(3-phenylphenyl)phenyl]dibenzofuran-1-yl]-1,3,5-triazine |
| SMILES | c1ccc(-c2ccc(-c3ccccc3-c3ccc4oc5cccc(-c6ccc(-c7nc(-c8ccccc8)nc(-c8ccccc8)n7)cc6)c5c4c3)cc2)cc1.c1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4cccc5oc6ccc(-c7cc(-c8ccccc8)cc(-c8cccc(-c9ccccc9)c8)c7)cc6c45)n3)cc2)cc1.c1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4cccc5oc6ccc(-c7cccc(-c8cccc(-c9ccccc9)c8)c7-c7ccccc7)cc6c45)n3)cc2)cc1 |
| InChI | InChI=1S/2C57H37N3O.C51H33N3O/c1-5-16-38(17-6-1)40-30-32-43(33-31-40)56-58-55(42-22-11-4-12-23-42)59-57(60-56)49-28-15-29-52-54(49)50-37-46(34-35-51(50)61-52)48-27-14-26-47(53(48)41-20-9-3-10-21-41)45-25-13-24-44(36-45)39-18-7-2-8-19-39;1-5-15-38(16-6-1)41-27-29-43(30-28-41)56-58-55(42-21-11-4-12-22-42)59-57(60-56)50-25-14-26-53-54(50)51-37-46(31-32-52(51)61-53)49-35-47(40-19-9-3-10-20-40)34-48(36-49)45-24-13-23-44(33-45)39-17-7-2-8-18-39;1-4-13-34(14-5-1)35-23-25-36(26-24-35)42-19-10-11-20-43(42)41-31-32-46-45(33-41)48-44(21-12-22-47(48)55-46)37-27-29-40(30-28-37)51-53-49(38-15-6-2-7-16-38)52-50(54-51)39-17-8-3-9-18-39/h2*1-37H;1-33H |
| InChIKey | QVZNFOKRJKNUBT-UHFFFAOYSA-N |
| XLogP | 43.65 |
| TPSA | 155.43 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 12 |
| Rotatable Bonds | 23 |
| Heavy Atoms | 177 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2263.73 |
| LogP ≤ 5 | 43.65 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 12 |