C282H167N17O9S — CID 159742632
3-dibenzofuran-2-yl-9-[3-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]phenyl]carbazole;3-dibenzofuran-2-yl-9-[3-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]phenyl]carbazole;9-(4-dibenzofuran-4-ylphenyl)-3-[8-(4-phenylquinazolin-2-yl)dibenzofuran-2-yl]carbazole;3-dibenzofuran-2-yl-9-[3-[8-(4-phenylquinazolin-2-yl)dibenzofuran-2-yl]phenyl]carbazole;3-dibenzofuran-2-yl-9-[4-[8-(4-phenylquinazolin-2-yl)dibenzofuran-2-yl]phenyl]carbazole (PubChem CID 159742632) has the molecular formula C282H167N17O9S and a molecular weight of 3969.61 g/mol. Its IUPAC name is 3-dibenzofuran-2-yl-9-[3-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]phenyl]carbazole;3-dibenzofuran-2-yl-9-[3-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]phenyl]carbazole;9-(4-dibenzofuran-4-ylphenyl)-3-[8-(4-phenylquinazolin-2-yl)dibenzofuran-2-yl]carbazole;3-dibenzofuran-2-yl-9-[3-[8-(4-phenylquinazolin-2-yl)dibenzofuran-2-yl]phenyl]carbazole;3-dibenzofuran-2-yl-9-[4-[8-(4-phenylquinazolin-2-yl)dibenzofuran-2-yl]phenyl]carbazole.
| Compound Name | 3-dibenzofuran-2-yl-9-[3-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]phenyl]carbazole;3-dibenzofuran-2-yl-9-[3-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]phenyl]carbazole;9-(4-dibenzofuran-4-ylphenyl)-3-[8-(4-phenylquinazolin-2-yl)dibenzofuran-2-yl]carbazole;3-dibenzofuran-2-yl-9-[3-[8-(4-phenylquinazolin-2-yl)dibenzofuran-2-yl]phenyl]carbazole;3-dibenzofuran-2-yl-9-[4-[8-(4-phenylquinazolin-2-yl)dibenzofuran-2-yl]phenyl]carbazole |
|---|---|
| PubChem CID | 159742632 |
| Molecular Formula | C282H167N17O9S |
| Molecular Weight | 3969.61 g/mol |
| Exact Mass | 3966.29 |
| IUPAC Name | 3-dibenzofuran-2-yl-9-[3-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]phenyl]carbazole;3-dibenzofuran-2-yl-9-[3-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]phenyl]carbazole;9-(4-dibenzofuran-4-ylphenyl)-3-[8-(4-phenylquinazolin-2-yl)dibenzofuran-2-yl]carbazole;3-dibenzofuran-2-yl-9-[3-[8-(4-phenylquinazolin-2-yl)dibenzofuran-2-yl]phenyl]carbazole;3-dibenzofuran-2-yl-9-[4-[8-(4-phenylquinazolin-2-yl)dibenzofuran-2-yl]phenyl]carbazole |
| SMILES | c1ccc(-c2nc(-c3ccc4oc5ccc(-c6ccc(-n7c8ccccc8c8cc(-c9ccc%10oc%11ccccc%11c%10c9)ccc87)cc6)cc5c4c3)nc3ccccc23)cc1.c1ccc(-c2nc(-c3ccc4oc5ccc(-c6ccc7c(c6)c6ccccc6n7-c6ccc(-c7cccc8c7oc7ccccc78)cc6)cc5c4c3)nc3ccccc23)cc1.c1ccc(-c2nc(-c3ccc4oc5ccc(-c6cccc(-n7c8ccccc8c8cc(-c9ccc%10oc%11ccccc%11c%10c9)ccc87)c6)cc5c4c3)nc3ccccc23)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc4oc5ccc(-c6cccc(-n7c8ccccc8c8cc(-c9ccc%10oc%11ccccc%11c%10c9)ccc87)c6)cc5c4c3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc4sc5ccc(-c6cccc(-n7c8ccccc8c8cc(-c9ccc%10oc%11ccccc%11c%10c9)ccc87)c6)cc5c4c3)n2)cc1 |
| InChI | InChI=1S/C57H34N4O2.C57H34N4OS.3C56H33N3O2/c1-3-12-35(13-4-1)55-58-56(36-14-5-2-6-15-36)60-57(59-55)41-25-29-54-48(34-41)47-33-39(23-28-53(47)63-54)37-16-11-17-42(30-37)61-49-20-9-7-18-43(49)45-31-38(22-26-50(45)61)40-24-27-52-46(32-40)44-19-8-10-21-51(44)62-52;1-3-12-35(13-4-1)55-58-56(36-14-5-2-6-15-36)60-57(59-55)41-25-29-54-48(34-41)47-33-40(24-28-53(47)63-54)37-16-11-17-42(30-37)61-49-20-9-7-18-43(49)45-31-38(22-26-50(45)61)39-23-27-52-46(32-39)44-19-8-10-21-51(44)62-52;1-2-11-34(12-3-1)55-43-17-4-7-18-48(43)57-56(58-55)39-24-28-54-47(33-39)46-32-37(22-27-53(46)61-54)35-13-10-14-40(29-35)59-49-19-8-5-15-41(49)44-30-36(21-25-50(44)59)38-23-26-52-45(31-38)42-16-6-9-20-51(42)60-52;1-2-11-35(12-3-1)54-44-15-4-7-18-48(44)57-56(58-54)38-25-30-53-47(33-38)46-32-37(24-29-52(46)60-53)36-23-28-50-45(31-36)41-13-5-8-19-49(41)59(50)39-26-21-34(22-27-39)40-16-10-17-43-42-14-6-9-20-51(42)61-55(40)43;1-2-10-35(11-3-1)55-43-14-4-7-15-48(43)57-56(58-55)39-23-29-54-47(33-39)46-31-36(21-27-53(46)61-54)34-18-24-40(25-19-34)59-49-16-8-5-12-41(49)44-30-37(20-26-50(44)59)38-22-28-52-45(32-38)42-13-6-9-17-51(42)60-52/h2*1-34H;3*1-33H |
| InChIKey | NCQOVRCOHSSWQK-UHFFFAOYSA-N |
| XLogP | 76.25 |
| TPSA | 297.59 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 27 |
| Rotatable Bonds | 27 |
| Heavy Atoms | 309 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 3969.61 |
| LogP ≤ 5 | 76.25 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 27 |