C346H224N4O8 — CID 157351445
3,6-bis[6-(9,9-dimethylfluoren-2-yl)dibenzofuran-4-yl]-9-[4-(10-phenylanthracen-9-yl)phenyl]carbazole;9-[4-(10-phenylanthracen-9-yl)phenyl]-3,6-bis[6-(3-phenylphenyl)dibenzofuran-4-yl]carbazole;9-[4-(10-phenylanthracen-9-yl)phenyl]-3,6-bis[6-(4-phenylphenyl)dibenzofuran-4-yl]carbazole;9-[4-(10-phenylanthracen-9-yl)phenyl]-3,6-bis[6-(5,6,7,8-tetrahydronaphthalen-1-yl)dibenzofuran-4-yl]carbazole (PubChem CID 157351445) has the molecular formula C346H224N4O8 and a molecular weight of 4565.62 g/mol. Its IUPAC name is 3,6-bis[6-(9,9-dimethylfluoren-2-yl)dibenzofuran-4-yl]-9-[4-(10-phenylanthracen-9-yl)phenyl]carbazole;9-[4-(10-phenylanthracen-9-yl)phenyl]-3,6-bis[6-(3-phenylphenyl)dibenzofuran-4-yl]carbazole;9-[4-(10-phenylanthracen-9-yl)phenyl]-3,6-bis[6-(4-phenylphenyl)dibenzofuran-4-yl]carbazole;9-[4-(10-phenylanthracen-9-yl)phenyl]-3,6-bis[6-(5,6,7,8-tetrahydronaphthalen-1-yl)dibenzofuran-4-yl]carbazole.
| Compound Name | 3,6-bis[6-(9,9-dimethylfluoren-2-yl)dibenzofuran-4-yl]-9-[4-(10-phenylanthracen-9-yl)phenyl]carbazole;9-[4-(10-phenylanthracen-9-yl)phenyl]-3,6-bis[6-(3-phenylphenyl)dibenzofuran-4-yl]carbazole;9-[4-(10-phenylanthracen-9-yl)phenyl]-3,6-bis[6-(4-phenylphenyl)dibenzofuran-4-yl]carbazole;9-[4-(10-phenylanthracen-9-yl)phenyl]-3,6-bis[6-(5,6,7,8-tetrahydronaphthalen-1-yl)dibenzofuran-4-yl]carbazole |
|---|---|
| PubChem CID | 157351445 |
| Molecular Formula | C346H224N4O8 |
| Molecular Weight | 4565.62 g/mol |
| Exact Mass | 4561.72 |
| IUPAC Name | 3,6-bis[6-(9,9-dimethylfluoren-2-yl)dibenzofuran-4-yl]-9-[4-(10-phenylanthracen-9-yl)phenyl]carbazole;9-[4-(10-phenylanthracen-9-yl)phenyl]-3,6-bis[6-(3-phenylphenyl)dibenzofuran-4-yl]carbazole;9-[4-(10-phenylanthracen-9-yl)phenyl]-3,6-bis[6-(4-phenylphenyl)dibenzofuran-4-yl]carbazole;9-[4-(10-phenylanthracen-9-yl)phenyl]-3,6-bis[6-(5,6,7,8-tetrahydronaphthalen-1-yl)dibenzofuran-4-yl]carbazole |
| SMILES | CC1(C)c2ccccc2-c2ccc(-c3cccc4c3oc3c(-c5ccc6c(c5)c5cc(-c7cccc8c7oc7c(-c9ccc%10c(c9)C(C)(C)c9ccccc9-%10)cccc78)ccc5n6-c5ccc(-c6c7ccccc7c(-c7ccccc7)c7ccccc67)cc5)cccc34)cc21.c1ccc(-c2c3ccccc3c(-c3ccc(-n4c5ccc(-c6cccc7c6oc6c(-c8cccc9c8CCCC9)cccc67)cc5c5cc(-c6cccc7c6oc6c(-c8cccc9c8CCCC9)cccc67)ccc54)cc3)c3ccccc23)cc1.c1ccc(-c2ccc(-c3cccc4c3oc3c(-c5ccc6c(c5)c5cc(-c7cccc8c7oc7c(-c9ccc(-c%10ccccc%10)cc9)cccc78)ccc5n6-c5ccc(-c6c7ccccc7c(-c7ccccc7)c7ccccc67)cc5)cccc34)cc2)cc1.c1ccc(-c2cccc(-c3cccc4c3oc3c(-c5ccc6c(c5)c5cc(-c7cccc8c7oc7c(-c9cccc(-c%10ccccc%10)c9)cccc78)ccc5n6-c5ccc(-c6c7ccccc7c(-c7ccccc7)c7ccccc67)cc5)cccc34)c2)cc1 |
| InChI | InChI=1S/C92H61NO2.2C86H53NO2.C82H57NO2/c1-91(2)79-36-14-12-22-65(79)67-46-40-58(52-81(67)91)63-30-18-34-75-73-32-16-28-61(87(73)94-89(63)75)56-42-48-83-77(50-56)78-51-57(62-29-17-33-74-76-35-19-31-64(90(76)95-88(62)74)59-41-47-68-66-23-13-15-37-80(66)92(3,4)82(68)53-59)43-49-84(78)93(83)60-44-38-55(39-45-60)86-71-26-10-8-24-69(71)85(54-20-6-5-7-21-54)70-25-9-11-27-72(70)86;1-4-20-54(21-5-1)58-26-14-28-60(50-58)65-34-16-38-73-75-40-18-36-67(85(75)88-83(65)73)62-44-48-79-77(52-62)78-53-63(68-37-19-41-76-74-39-17-35-66(84(74)89-86(68)76)61-29-15-27-59(51-61)55-22-6-2-7-23-55)45-49-80(78)87(79)64-46-42-57(43-47-64)82-71-32-12-10-30-69(71)81(56-24-8-3-9-25-56)70-31-11-13-33-72(70)82;1-4-18-54(19-5-1)56-36-40-58(41-37-56)65-28-14-32-73-75-34-16-30-67(85(75)88-83(65)73)62-46-50-79-77(52-62)78-53-63(68-31-17-35-76-74-33-15-29-66(84(74)89-86(68)76)59-42-38-57(39-43-59)55-20-6-2-7-21-55)47-51-80(78)87(79)64-48-44-61(45-49-64)82-71-26-12-10-24-69(71)81(60-22-8-3-9-23-60)70-25-11-13-27-72(70)82;1-2-20-52(21-3-1)77-63-26-8-10-28-65(63)78(66-29-11-9-27-64(66)77)53-40-44-56(45-41-53)83-75-46-42-54(59-30-14-36-69-71-38-16-34-67(81(71)84-79(59)69)61-32-12-22-50-18-4-6-24-57(50)61)48-73(75)74-49-55(43-47-76(74)83)60-31-15-37-70-72-39-17-35-68(82(72)85-80(60)70)62-33-13-23-51-19-5-7-25-58(51)62/h5-53H,1-4H3;2*1-53H;1-3,8-17,20-23,26-49H,4-7,18-19,24-25H2 |
| InChIKey | BHOTZSXAOLIXNY-UHFFFAOYSA-N |
| XLogP | 96.60 |
| TPSA | 124.84 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 12 |
| Rotatable Bonds | 32 |
| Heavy Atoms | 358 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 4565.62 |
| LogP ≤ 5 | 96.60 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 12 |