C317H193N23O6 — CID 159164631
9-[7-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]carbazole;9-[7-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-3,6-diphenylcarbazole;9-[7-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-2-phenylcarbazole;9-[7-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-3-phenylcarbazole;9-[7-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-4-phenylcarbazole;9-[7-(4,6-diphenylpyrimidin-2-yl)dibenzofuran-2-yl]-2,7-diphenylcarbazole (PubChem CID 159164631) has the molecular formula C317H193N23O6 and a molecular weight of 4420.19 g/mol. Its IUPAC name is 9-[7-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]carbazole;9-[7-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-3,6-diphenylcarbazole;9-[7-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-2-phenylcarbazole;9-[7-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-3-phenylcarbazole;9-[7-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-4-phenylcarbazole;9-[7-(4,6-diphenylpyrimidin-2-yl)dibenzofuran-2-yl]-2,7-diphenylcarbazole.
| Compound Name | 9-[7-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]carbazole;9-[7-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-3,6-diphenylcarbazole;9-[7-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-2-phenylcarbazole;9-[7-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-3-phenylcarbazole;9-[7-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-4-phenylcarbazole;9-[7-(4,6-diphenylpyrimidin-2-yl)dibenzofuran-2-yl]-2,7-diphenylcarbazole |
|---|---|
| PubChem CID | 159164631 |
| Molecular Formula | C317H193N23O6 |
| Molecular Weight | 4420.19 g/mol |
| Exact Mass | 4416.55 |
| IUPAC Name | 9-[7-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]carbazole;9-[7-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-3,6-diphenylcarbazole;9-[7-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-2-phenylcarbazole;9-[7-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-3-phenylcarbazole;9-[7-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-4-phenylcarbazole;9-[7-(4,6-diphenylpyrimidin-2-yl)dibenzofuran-2-yl]-2,7-diphenylcarbazole |
| SMILES | c1ccc(-c2ccc3c(c2)c2cc(-c4ccccc4)ccc2n3-c2ccc3oc4cc(-c5nc(-c6ccc7ccccc7c6)nc(-c6ccc7ccccc7c6)n5)ccc4c3c2)cc1.c1ccc(-c2ccc3c(c2)c2ccccc2n3-c2ccc3oc4cc(-c5nc(-c6ccc7ccccc7c6)nc(-c6ccc7ccccc7c6)n5)ccc4c3c2)cc1.c1ccc(-c2ccc3c4ccc(-c5ccccc5)cc4n(-c4ccc5oc6cc(-c7nc(-c8ccccc8)cc(-c8ccccc8)n7)ccc6c5c4)c3c2)cc1.c1ccc(-c2ccc3c4ccccc4n(-c4ccc5oc6cc(-c7nc(-c8ccc9ccccc9c8)nc(-c8ccc9ccccc9c8)n7)ccc6c5c4)c3c2)cc1.c1ccc(-c2cccc3c2c2ccccc2n3-c2ccc3oc4cc(-c5nc(-c6ccc7ccccc7c6)nc(-c6ccc7ccccc7c6)n5)ccc4c3c2)cc1.c1ccc2cc(-c3nc(-c4ccc5ccccc5c4)nc(-c4ccc5c(c4)oc4ccc(-n6c7ccccc7c7ccccc76)cc45)n3)ccc2c1 |
| InChI | InChI=1S/C59H36N4O.3C53H32N4O.C52H33N3O.C47H28N4O/c1-3-11-37(12-4-1)43-24-28-53-50(33-43)51-34-44(38-13-5-2-6-14-38)25-29-54(51)63(53)48-26-30-55-52(36-48)49-27-23-47(35-56(49)64-55)59-61-57(45-21-19-39-15-7-9-17-41(39)31-45)60-58(62-59)46-22-20-40-16-8-10-18-42(40)32-46;1-2-13-35(14-3-1)42-18-10-20-47-50(42)44-17-8-9-19-46(44)57(47)41-26-28-48-45(32-41)43-27-25-40(31-49(43)58-48)53-55-51(38-23-21-33-11-4-6-15-36(33)29-38)54-52(56-53)39-24-22-34-12-5-7-16-37(34)30-39;1-2-10-33(11-3-1)38-23-26-48-45(30-38)43-16-8-9-17-47(43)57(48)42-24-27-49-46(32-42)44-25-22-41(31-50(44)58-49)53-55-51(39-20-18-34-12-4-6-14-36(34)28-39)54-52(56-53)40-21-19-35-13-5-7-15-37(35)29-40;1-2-10-33(11-3-1)38-22-25-44-43-16-8-9-17-47(43)57(48(44)30-38)42-24-27-49-46(32-42)45-26-23-41(31-50(45)58-49)53-55-51(39-20-18-34-12-4-6-14-36(34)28-39)54-52(56-53)40-21-19-35-13-5-7-15-37(35)29-40;1-5-13-34(14-6-1)38-21-25-42-43-26-22-39(35-15-7-2-8-16-35)30-49(43)55(48(42)29-38)41-24-28-50-45(32-41)44-27-23-40(31-51(44)56-50)52-53-46(36-17-9-3-10-18-36)33-47(54-52)37-19-11-4-12-20-37;1-3-11-31-25-33(19-17-29(31)9-1)45-48-46(34-20-18-30-10-2-4-12-32(30)26-34)50-47(49-45)35-21-23-39-40-28-36(22-24-43(40)52-44(39)27-35)51-41-15-7-5-13-37(41)38-14-6-8-16-42(38)51/h1-36H;3*1-32H;1-33H;1-28H |
| InChIKey | KKXMKJAUIDBYLQ-UHFFFAOYSA-N |
| XLogP | 83.02 |
| TPSA | 327.55 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 29 |
| Rotatable Bonds | 31 |
| Heavy Atoms | 346 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 4420.19 |
| LogP ≤ 5 | 83.02 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 29 |