C296H196N22OS — CID 157176080
3-dibenzofuran-2-yl-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;3-dibenzothiophen-2-yl-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;3-[3-[2-(9,9-dimethylfluoren-2-yl)-6-phenyl-4-pyridinyl]phenyl]-9-phenylcarbazole;3-[3-[6-(9,9-dimethylfluoren-2-yl)-2-phenylpyrimidin-4-yl]phenyl]-9-phenylcarbazole;3-[9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-2-yl]-9-phenylcarbazole;2-[9-(3-phenylphenyl)carbazol-3-yl]-9-[4-(4-phenylquinazolin-2-yl)phenyl]carbazole (PubChem CID 157176080) has the molecular formula C296H196N22OS and a molecular weight of 4109.04 g/mol. Its IUPAC name is 3-dibenzofuran-2-yl-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;3-dibenzothiophen-2-yl-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;3-[3-[2-(9,9-dimethylfluoren-2-yl)-6-phenyl-4-pyridinyl]phenyl]-9-phenylcarbazole;3-[3-[6-(9,9-dimethylfluoren-2-yl)-2-phenylpyrimidin-4-yl]phenyl]-9-phenylcarbazole;3-[9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-2-yl]-9-phenylcarbazole;2-[9-(3-phenylphenyl)carbazol-3-yl]-9-[4-(4-phenylquinazolin-2-yl)phenyl]carbazole.
| Compound Name | 3-dibenzofuran-2-yl-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;3-dibenzothiophen-2-yl-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;3-[3-[2-(9,9-dimethylfluoren-2-yl)-6-phenyl-4-pyridinyl]phenyl]-9-phenylcarbazole;3-[3-[6-(9,9-dimethylfluoren-2-yl)-2-phenylpyrimidin-4-yl]phenyl]-9-phenylcarbazole;3-[9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-2-yl]-9-phenylcarbazole;2-[9-(3-phenylphenyl)carbazol-3-yl]-9-[4-(4-phenylquinazolin-2-yl)phenyl]carbazole |
|---|---|
| PubChem CID | 157176080 |
| Molecular Formula | C296H196N22OS |
| Molecular Weight | 4109.04 g/mol |
| Exact Mass | 4105.57 |
| IUPAC Name | 3-dibenzofuran-2-yl-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;3-dibenzothiophen-2-yl-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;3-[3-[2-(9,9-dimethylfluoren-2-yl)-6-phenyl-4-pyridinyl]phenyl]-9-phenylcarbazole;3-[3-[6-(9,9-dimethylfluoren-2-yl)-2-phenylpyrimidin-4-yl]phenyl]-9-phenylcarbazole;3-[9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-2-yl]-9-phenylcarbazole;2-[9-(3-phenylphenyl)carbazol-3-yl]-9-[4-(4-phenylquinazolin-2-yl)phenyl]carbazole |
| SMILES | CC1(C)c2ccccc2-c2ccc(-c3cc(-c4cccc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)c4)cc(-c4ccccc4)n3)cc21.CC1(C)c2ccccc2-c2ccc(-c3cc(-c4cccc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)c4)nc(-c4ccccc4)n3)cc21.c1ccc(-c2cccc(-n3c4ccccc4c4cc(-c5ccc6c7ccccc7n(-c7ccc(-c8nc(-c9ccccc9)c9ccccc9n8)cc7)c6c5)ccc43)c2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-n4c5ccccc5c5cc(-c6ccc7oc8ccccc8c7c6)ccc54)cc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-n4c5ccccc5c5cc(-c6ccc7sc8ccccc8c7c6)ccc54)cc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccccc3-n3c4ccccc4c4ccc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)cc43)n2)cc1 |
| InChI | InChI=1S/C56H36N4.C51H33N5.C50H36N2.C49H35N3.C45H28N4O.C45H28N4S/c1-3-14-37(15-4-1)40-18-13-19-44(34-40)60-52-25-12-9-21-46(52)49-35-41(29-33-53(49)60)42-28-32-47-45-20-8-11-24-51(45)59(54(47)36-42)43-30-26-39(27-31-43)56-57-50-23-10-7-22-48(50)55(58-56)38-16-5-2-6-17-38;1-4-16-34(17-5-1)49-52-50(35-18-6-2-7-19-35)54-51(53-49)42-24-12-15-27-46(42)56-45-26-14-10-22-39(45)41-30-28-37(33-48(41)56)36-29-31-47-43(32-36)40-23-11-13-25-44(40)55(47)38-20-8-3-9-21-38;1-50(2)44-22-11-9-20-40(44)41-26-24-37(30-45(41)50)47-32-38(31-46(51-47)33-14-5-3-6-15-33)35-17-13-16-34(28-35)36-25-27-49-43(29-36)42-21-10-12-23-48(42)52(49)39-18-7-4-8-19-39;1-49(2)42-22-11-9-20-38(42)39-26-24-36(30-43(39)49)45-31-44(50-48(51-45)32-14-5-3-6-15-32)35-17-13-16-33(28-35)34-25-27-47-41(29-34)40-21-10-12-23-46(40)52(47)37-18-7-4-8-19-37;2*1-3-11-29(12-4-1)43-46-44(30-13-5-2-6-14-30)48-45(47-43)31-19-23-34(24-20-31)49-39-17-9-7-15-35(39)37-27-32(21-25-40(37)49)33-22-26-42-38(28-33)36-16-8-10-18-41(36)50-42/h1-36H;1-33H;3-32H,1-2H3;3-31H,1-2H3;2*1-28H |
| InChIKey | AOADEAVYZNYHGR-UHFFFAOYSA-N |
| XLogP | 76.47 |
| TPSA | 233.04 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 24 |
| Rotatable Bonds | 32 |
| Heavy Atoms | 320 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 4109.04 |
| LogP ≤ 5 | 76.47 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 24 |