C400H245N35O8 — CID 158313830
12-[7-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)dibenzofuran-3-yl]-11-phenylindolo[2,3-a]carbazole;5-[7-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)dibenzofuran-3-yl]-7-phenylindolo[2,3-b]carbazole;9-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]carbazole;9-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-2,7-diphenylcarbazole;9-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-3,6-diphenylcarbazole;9-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-2-phenylcarbazole;9-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-3-phenylcarbazole;12-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-11-phenylindolo[2,3-a]carbazole (PubChem CID 158313830) has the molecular formula C400H245N35O8 and a molecular weight of 5669.60 g/mol. Its IUPAC name is 12-[7-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)dibenzofuran-3-yl]-11-phenylindolo[2,3-a]carbazole;5-[7-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)dibenzofuran-3-yl]-7-phenylindolo[2,3-b]carbazole;9-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]carbazole;9-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-2,7-diphenylcarbazole;9-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-3,6-diphenylcarbazole;9-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-2-phenylcarbazole;9-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-3-phenylcarbazole;12-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-11-phenylindolo[2,3-a]carbazole.
| Compound Name | 12-[7-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)dibenzofuran-3-yl]-11-phenylindolo[2,3-a]carbazole;5-[7-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)dibenzofuran-3-yl]-7-phenylindolo[2,3-b]carbazole;9-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]carbazole;9-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-2,7-diphenylcarbazole;9-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-3,6-diphenylcarbazole;9-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-2-phenylcarbazole;9-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-3-phenylcarbazole;12-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-11-phenylindolo[2,3-a]carbazole |
|---|---|
| PubChem CID | 158313830 |
| Molecular Formula | C400H245N35O8 |
| Molecular Weight | 5669.60 g/mol |
| Exact Mass | 5664.98 |
| IUPAC Name | 12-[7-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)dibenzofuran-3-yl]-11-phenylindolo[2,3-a]carbazole;5-[7-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)dibenzofuran-3-yl]-7-phenylindolo[2,3-b]carbazole;9-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]carbazole;9-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-2,7-diphenylcarbazole;9-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-3,6-diphenylcarbazole;9-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-2-phenylcarbazole;9-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-3-phenylcarbazole;12-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-11-phenylindolo[2,3-a]carbazole |
| SMILES | c1ccc(-c2ccc3c(c2)c2cc(-c4ccccc4)ccc2n3-c2ccc3oc4cc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)ccc4c3c2)cc1.c1ccc(-c2ccc3c(c2)c2ccccc2n3-c2ccc3oc4cc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)ccc4c3c2)cc1.c1ccc(-c2ccc3c4ccc(-c5ccccc5)cc4n(-c4ccc5oc6cc(-c7nc(-c8ccccc8)nc(-c8ccccc8)n7)ccc6c5c4)c3c2)cc1.c1ccc(-c2ccc3c4ccccc4n(-c4ccc5oc6cc(-c7nc(-c8ccccc8)nc(-c8ccccc8)n7)ccc6c5c4)c3c2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc4c(c3)oc3ccc(-n5c6ccccc6c6ccc7c8ccccc8n(-c8ccccc8)c7c65)cc34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc4c(c3)oc3ccc(-n5c6ccccc6c6ccccc65)cc34)n2)cc1.c1ccc(-n2c3ccccc3c3cc4c5ccccc5n(-c5ccc6c(c5)oc5cc(-c7nc(-c8ccc9ccccc9c8)nc(-c8ccc9ccccc9c8)n7)ccc56)c4cc32)cc1.c1ccc(-n2c3ccccc3c3ccc4c5ccccc5n(-c5ccc6c(c5)oc5cc(-c7nc(-c8ccc9ccccc9c8)nc(-c8ccc9ccccc9c8)n7)ccc56)c4c32)cc1 |
| InChI | InChI=1S/2C59H35N5O.C51H31N5O.2C51H32N4O.2C45H28N4O.C39H24N4O/c1-2-16-43(17-3-1)63-51-20-10-8-18-45(51)49-34-50-46-19-9-11-21-52(46)64(54(50)35-53(49)63)44-27-29-48-47-28-26-42(32-55(47)65-56(48)33-44)59-61-57(40-24-22-36-12-4-6-14-38(36)30-40)60-58(62-59)41-25-23-37-13-5-7-15-39(37)31-41;1-2-16-43(17-3-1)63-51-20-10-8-18-45(51)49-30-31-50-46-19-9-11-21-52(46)64(56(50)55(49)63)44-27-29-48-47-28-26-42(34-53(47)65-54(48)35-44)59-61-57(40-24-22-36-12-4-6-14-38(36)32-40)60-58(62-59)41-25-23-37-13-5-7-15-39(37)33-41;1-4-14-32(15-5-1)49-52-50(33-16-6-2-7-17-33)54-51(53-49)34-24-26-39-42-31-36(25-29-45(42)57-46(39)30-34)56-44-23-13-11-21-38(44)41-28-27-40-37-20-10-12-22-43(37)55(47(40)48(41)56)35-18-8-3-9-19-35;1-5-13-33(14-6-1)37-22-26-45-42(29-37)43-30-38(34-15-7-2-8-16-34)23-27-46(43)55(45)40-24-28-47-44(32-40)41-25-21-39(31-48(41)56-47)51-53-49(35-17-9-3-10-18-35)52-50(54-51)36-19-11-4-12-20-36;1-5-13-33(14-6-1)37-21-25-41-42-26-22-38(34-15-7-2-8-16-34)30-46(42)55(45(41)29-37)40-24-28-47-44(32-40)43-27-23-39(31-48(43)56-47)51-53-49(35-17-9-3-10-18-35)52-50(54-51)36-19-11-4-12-20-36;1-4-12-29(13-5-1)32-21-24-40-37(26-32)35-18-10-11-19-39(35)49(40)34-22-25-41-38(28-34)36-23-20-33(27-42(36)50-41)45-47-43(30-14-6-2-7-15-30)46-44(48-45)31-16-8-3-9-17-31;1-4-12-29(13-5-1)32-20-23-36-35-18-10-11-19-39(35)49(40(36)26-32)34-22-25-41-38(28-34)37-24-21-33(27-42(37)50-41)45-47-43(30-14-6-2-7-15-30)46-44(48-45)31-16-8-3-9-17-31;1-3-11-25(12-4-1)37-40-38(26-13-5-2-6-14-26)42-39(41-37)27-19-21-31-32-24-28(20-22-35(32)44-36(31)23-27)43-33-17-9-7-15-29(33)30-16-8-10-18-34(30)43/h2*1-35H;1-31H;2*1-32H;2*1-28H;1-24H |
| InChIKey | GNZVBLSVCOQJTH-UHFFFAOYSA-N |
| XLogP | 102.86 |
| TPSA | 468.71 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 43 |
| Rotatable Bonds | 41 |
| Heavy Atoms | 443 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 5669.60 |
| LogP ≤ 5 | 102.86 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 43 |