C308H199N21 — CID 162258475
12-[2,6-bis(4-phenylphenyl)-4-pyridinyl]-11-phenylindolo[2,3-a]carbazole;11-(3-carbazol-9-ylphenyl)-12-(2,6-diphenyl-4-pyridinyl)indolo[2,3-a]carbazole;12-[2,6-di(phenanthren-9-yl)-4-pyridinyl]-11-phenylindolo[2,3-a]carbazole;12-(2,6-diphenyl-4-pyridinyl)-11-phenyl-3,8-dipyridin-2-ylindolo[2,3-a]carbazole;12-(2,6-diphenyl-4-pyridinyl)-11-phenylindolo[2,3-a]carbazole;12-(2,6-diphenyl-4-pyridinyl)-3,8,11-triphenylindolo[2,3-a]carbazole (PubChem CID 162258475) has the molecular formula C308H199N21 and a molecular weight of 4194.13 g/mol. Its IUPAC name is 12-[2,6-bis(4-phenylphenyl)-4-pyridinyl]-11-phenylindolo[2,3-a]carbazole;11-(3-carbazol-9-ylphenyl)-12-(2,6-diphenyl-4-pyridinyl)indolo[2,3-a]carbazole;12-[2,6-di(phenanthren-9-yl)-4-pyridinyl]-11-phenylindolo[2,3-a]carbazole;12-(2,6-diphenyl-4-pyridinyl)-11-phenyl-3,8-dipyridin-2-ylindolo[2,3-a]carbazole;12-(2,6-diphenyl-4-pyridinyl)-11-phenylindolo[2,3-a]carbazole;12-(2,6-diphenyl-4-pyridinyl)-3,8,11-triphenylindolo[2,3-a]carbazole.
| Compound Name | 12-[2,6-bis(4-phenylphenyl)-4-pyridinyl]-11-phenylindolo[2,3-a]carbazole;11-(3-carbazol-9-ylphenyl)-12-(2,6-diphenyl-4-pyridinyl)indolo[2,3-a]carbazole;12-[2,6-di(phenanthren-9-yl)-4-pyridinyl]-11-phenylindolo[2,3-a]carbazole;12-(2,6-diphenyl-4-pyridinyl)-11-phenyl-3,8-dipyridin-2-ylindolo[2,3-a]carbazole;12-(2,6-diphenyl-4-pyridinyl)-11-phenylindolo[2,3-a]carbazole;12-(2,6-diphenyl-4-pyridinyl)-3,8,11-triphenylindolo[2,3-a]carbazole |
|---|---|
| PubChem CID | 162258475 |
| Molecular Formula | C308H199N21 |
| Molecular Weight | 4194.13 g/mol |
| Exact Mass | 4190.62 |
| IUPAC Name | 12-[2,6-bis(4-phenylphenyl)-4-pyridinyl]-11-phenylindolo[2,3-a]carbazole;11-(3-carbazol-9-ylphenyl)-12-(2,6-diphenyl-4-pyridinyl)indolo[2,3-a]carbazole;12-[2,6-di(phenanthren-9-yl)-4-pyridinyl]-11-phenylindolo[2,3-a]carbazole;12-(2,6-diphenyl-4-pyridinyl)-11-phenyl-3,8-dipyridin-2-ylindolo[2,3-a]carbazole;12-(2,6-diphenyl-4-pyridinyl)-11-phenylindolo[2,3-a]carbazole;12-(2,6-diphenyl-4-pyridinyl)-3,8,11-triphenylindolo[2,3-a]carbazole |
| SMILES | c1ccc(-c2cc(-n3c4ccc(-c5ccccn5)cc4c4ccc5c6cc(-c7ccccn7)ccc6n(-c6ccccc6)c5c43)cc(-c3ccccc3)n2)cc1.c1ccc(-c2cc(-n3c4ccccc4c4ccc5c6ccccc6n(-c6cccc(-n7c8ccccc8c8ccccc87)c6)c5c43)cc(-c3ccccc3)n2)cc1.c1ccc(-c2cc(-n3c4ccccc4c4ccc5c6ccccc6n(-c6ccccc6)c5c43)cc(-c3ccccc3)n2)cc1.c1ccc(-c2ccc(-c3cc(-n4c5ccccc5c5ccc6c7ccccc7n(-c7ccccc7)c6c54)cc(-c4ccc(-c5ccccc5)cc4)n3)cc2)cc1.c1ccc(-c2ccc3c(c2)c2ccc4c5cc(-c6ccccc6)ccc5n(-c5cc(-c6ccccc6)nc(-c6ccccc6)c5)c4c2n3-c2ccccc2)cc1.c1ccc(-n2c3ccccc3c3ccc4c5ccccc5n(-c5cc(-c6cc7ccccc7c7ccccc67)nc(-c6cc7ccccc7c7ccccc67)c5)c4c32)cc1 |
| InChI | InChI=1S/C57H35N3.C53H34N4.2C53H35N3.C51H33N5.C41H27N3/c1-2-18-38(19-3-1)59-54-28-14-12-26-46(54)48-30-31-49-47-27-13-15-29-55(47)60(57(49)56(48)59)39-34-52(50-32-36-16-4-6-20-40(36)42-22-8-10-24-44(42)50)58-53(35-39)51-33-37-17-5-7-21-41(37)43-23-9-11-25-45(43)51;1-3-16-35(17-4-1)46-33-39(34-47(54-46)36-18-5-2-6-19-36)57-51-29-14-10-25-43(51)45-31-30-44-42-24-9-13-28-50(42)56(52(44)53(45)57)38-21-15-20-37(32-38)55-48-26-11-7-22-40(48)41-23-8-12-27-49(41)55;1-6-16-36(17-7-1)40-26-30-50-46(32-40)44-28-29-45-47-33-41(37-18-8-2-9-19-37)27-31-51(47)56(53(45)52(44)55(50)42-24-14-5-15-25-42)43-34-48(38-20-10-3-11-21-38)54-49(35-43)39-22-12-4-13-23-39;1-4-14-36(15-5-1)38-24-28-40(29-25-38)48-34-43(35-49(54-48)41-30-26-39(27-31-41)37-16-6-2-7-17-37)56-51-23-13-11-21-45(51)47-33-32-46-44-20-10-12-22-50(44)55(52(46)53(47)56)42-18-8-3-9-19-42;1-4-14-34(15-5-1)46-32-39(33-47(54-46)35-16-6-2-7-17-35)56-49-27-23-37(45-21-11-13-29-53-45)31-43(49)41-25-24-40-42-30-36(44-20-10-12-28-52-44)22-26-48(42)55(50(40)51(41)56)38-18-8-3-9-19-38;1-4-14-28(15-5-1)36-26-31(27-37(42-36)29-16-6-2-7-17-29)44-39-23-13-11-21-33(39)35-25-24-34-32-20-10-12-22-38(32)43(40(34)41(35)44)30-18-8-3-9-19-30/h1-35H;1-34H;2*1-35H;1-33H;1-27H |
| InChIKey | ZYXJICVRYGVJNE-UHFFFAOYSA-N |
| XLogP | 80.16 |
| TPSA | 167.21 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 21 |
| Rotatable Bonds | 31 |
| Heavy Atoms | 329 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 4194.13 |
| LogP ≤ 5 | 80.16 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 21 |