C284H202N12 — CID 161274428
12-[3,5-bis(4-tert-butylphenyl)phenyl]-11-phenylindolo[2,3-a]carbazole;12-[4-[3,5-bis(3-methylphenyl)phenyl]phenyl]-11-phenylindolo[2,3-a]carbazole;12-[3,5-bis(3-phenylphenyl)phenyl]-11-phenylindolo[2,3-a]carbazole;12-(3,5-diphenylphenyl)-3,11-diphenylindolo[2,3-a]carbazole;12-(3,5-diphenylphenyl)-11-phenylindolo[2,3-a]carbazole;12-(4-naphthalen-2-ylphenyl)-11-phenylindolo[2,3-a]carbazole (PubChem CID 161274428) has the molecular formula C284H202N12 and a molecular weight of 3782.82 g/mol. Its IUPAC name is 12-[3,5-bis(4-tert-butylphenyl)phenyl]-11-phenylindolo[2,3-a]carbazole;12-[4-[3,5-bis(3-methylphenyl)phenyl]phenyl]-11-phenylindolo[2,3-a]carbazole;12-[3,5-bis(3-phenylphenyl)phenyl]-11-phenylindolo[2,3-a]carbazole;12-(3,5-diphenylphenyl)-3,11-diphenylindolo[2,3-a]carbazole;12-(3,5-diphenylphenyl)-11-phenylindolo[2,3-a]carbazole;12-(4-naphthalen-2-ylphenyl)-11-phenylindolo[2,3-a]carbazole.
| Compound Name | 12-[3,5-bis(4-tert-butylphenyl)phenyl]-11-phenylindolo[2,3-a]carbazole;12-[4-[3,5-bis(3-methylphenyl)phenyl]phenyl]-11-phenylindolo[2,3-a]carbazole;12-[3,5-bis(3-phenylphenyl)phenyl]-11-phenylindolo[2,3-a]carbazole;12-(3,5-diphenylphenyl)-3,11-diphenylindolo[2,3-a]carbazole;12-(3,5-diphenylphenyl)-11-phenylindolo[2,3-a]carbazole;12-(4-naphthalen-2-ylphenyl)-11-phenylindolo[2,3-a]carbazole |
|---|---|
| PubChem CID | 161274428 |
| Molecular Formula | C284H202N12 |
| Molecular Weight | 3782.82 g/mol |
| Exact Mass | 3779.62 |
| IUPAC Name | 12-[3,5-bis(4-tert-butylphenyl)phenyl]-11-phenylindolo[2,3-a]carbazole;12-[4-[3,5-bis(3-methylphenyl)phenyl]phenyl]-11-phenylindolo[2,3-a]carbazole;12-[3,5-bis(3-phenylphenyl)phenyl]-11-phenylindolo[2,3-a]carbazole;12-(3,5-diphenylphenyl)-3,11-diphenylindolo[2,3-a]carbazole;12-(3,5-diphenylphenyl)-11-phenylindolo[2,3-a]carbazole;12-(4-naphthalen-2-ylphenyl)-11-phenylindolo[2,3-a]carbazole |
| SMILES | CC(C)(C)c1ccc(-c2cc(-c3ccc(C(C)(C)C)cc3)cc(-n3c4ccccc4c4ccc5c6ccccc6n(-c6ccccc6)c5c43)c2)cc1.Cc1cccc(-c2cc(-c3ccc(-n4c5ccccc5c5ccc6c7ccccc7n(-c7ccccc7)c6c54)cc3)cc(-c3cccc(C)c3)c2)c1.c1ccc(-c2cc(-c3ccccc3)cc(-n3c4ccc(-c5ccccc5)cc4c4ccc5c6ccccc6n(-c6ccccc6)c5c43)c2)cc1.c1ccc(-c2cc(-c3ccccc3)cc(-n3c4ccccc4c4ccc5c6ccccc6n(-c6ccccc6)c5c43)c2)cc1.c1ccc(-c2cccc(-c3cc(-c4cccc(-c5ccccc5)c4)cc(-n4c5ccccc5c5ccc6c7ccccc7n(-c7ccccc7)c6c54)c3)c2)cc1.c1ccc(-n2c3ccccc3c3ccc4c5ccccc5n(-c5ccc(-c6ccc7ccccc7c6)cc5)c4c32)cc1 |
| InChI | InChI=1S/C54H36N2.C50H36N2.C50H44N2.C48H32N2.C42H28N2.C40H26N2/c1-4-16-37(17-5-1)39-20-14-22-41(32-39)43-34-44(42-23-15-21-40(33-42)38-18-6-2-7-19-38)36-46(35-43)56-52-29-13-11-27-48(52)50-31-30-49-47-26-10-12-28-51(47)55(53(49)54(50)56)45-24-8-3-9-25-45;1-33-12-10-14-36(28-33)39-30-38(31-40(32-39)37-15-11-13-34(2)29-37)35-22-24-42(25-23-35)52-48-21-9-7-19-44(48)46-27-26-45-43-18-6-8-20-47(43)51(49(45)50(46)52)41-16-4-3-5-17-41;1-49(2,3)37-24-20-33(21-25-37)35-30-36(34-22-26-38(27-23-34)50(4,5)6)32-40(31-35)52-46-19-13-11-17-42(46)44-29-28-43-41-16-10-12-18-45(41)51(47(43)48(44)52)39-14-8-7-9-15-39;1-5-15-33(16-6-1)36-25-28-46-44(32-36)43-27-26-42-41-23-13-14-24-45(41)49(39-21-11-4-12-22-39)47(42)48(43)50(46)40-30-37(34-17-7-2-8-18-34)29-38(31-40)35-19-9-3-10-20-35;1-4-14-29(15-5-1)31-26-32(30-16-6-2-7-17-30)28-34(27-31)44-40-23-13-11-21-36(40)38-25-24-37-35-20-10-12-22-39(35)43(41(37)42(38)44)33-18-8-3-9-19-33;1-2-12-31(13-3-1)41-37-16-8-6-14-33(37)35-24-25-36-34-15-7-9-17-38(34)42(40(36)39(35)41)32-22-20-28(21-23-32)30-19-18-27-10-4-5-11-29(27)26-30/h1-36H;3-32H,1-2H3;7-32H,1-6H3;1-32H;1-28H;1-26H |
| InChIKey | VEGBRNCRIKCDAZ-UHFFFAOYSA-N |
| XLogP | 76.65 |
| TPSA | 59.16 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 12 |
| Rotatable Bonds | 27 |
| Heavy Atoms | 296 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 3782.82 |
| LogP ≤ 5 | 76.65 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 12 |