C168H109N9O — CID 161096514
11,12-bis(4-phenylphenyl)indolo[2,3-a]carbazole;2-carbazol-9-yl-5,7-diphenylindolo[2,3-b]carbazole;2-dibenzofuran-4-yl-5,7-diphenylindolo[2,3-b]carbazole;12-(3-phenylphenyl)-11-(4-phenylphenyl)indolo[2,3-a]carbazole (PubChem CID 161096514) has the molecular formula C168H109N9O and a molecular weight of 2269.78 g/mol. Its IUPAC name is 11,12-bis(4-phenylphenyl)indolo[2,3-a]carbazole;2-carbazol-9-yl-5,7-diphenylindolo[2,3-b]carbazole;2-dibenzofuran-4-yl-5,7-diphenylindolo[2,3-b]carbazole;12-(3-phenylphenyl)-11-(4-phenylphenyl)indolo[2,3-a]carbazole.
| Compound Name | 11,12-bis(4-phenylphenyl)indolo[2,3-a]carbazole;2-carbazol-9-yl-5,7-diphenylindolo[2,3-b]carbazole;2-dibenzofuran-4-yl-5,7-diphenylindolo[2,3-b]carbazole;12-(3-phenylphenyl)-11-(4-phenylphenyl)indolo[2,3-a]carbazole |
|---|---|
| PubChem CID | 161096514 |
| Molecular Formula | C168H109N9O |
| Molecular Weight | 2269.78 g/mol |
| Exact Mass | 2267.88 |
| IUPAC Name | 11,12-bis(4-phenylphenyl)indolo[2,3-a]carbazole;2-carbazol-9-yl-5,7-diphenylindolo[2,3-b]carbazole;2-dibenzofuran-4-yl-5,7-diphenylindolo[2,3-b]carbazole;12-(3-phenylphenyl)-11-(4-phenylphenyl)indolo[2,3-a]carbazole |
| SMILES | c1ccc(-c2ccc(-n3c4ccccc4c4ccc5c6ccccc6n(-c6ccc(-c7ccccc7)cc6)c5c43)cc2)cc1.c1ccc(-c2ccc(-n3c4ccccc4c4ccc5c6ccccc6n(-c6cccc(-c7ccccc7)c6)c5c43)cc2)cc1.c1ccc(-n2c3ccccc3c3cc4c5cc(-c6cccc7c6oc6ccccc67)ccc5n(-c5ccccc5)c4cc32)cc1.c1ccc(-n2c3ccccc3c3cc4c5cc(-n6c7ccccc7c7ccccc76)ccc5n(-c5ccccc5)c4cc32)cc1 |
| InChI | InChI=1S/C42H27N3.C42H26N2O.2C42H28N2/c1-3-13-28(14-4-1)43-39-22-12-9-19-33(39)35-26-36-34-25-30(45-37-20-10-7-17-31(37)32-18-8-11-21-38(32)45)23-24-40(34)44(42(36)27-41(35)43)29-15-5-2-6-16-29;1-3-12-28(13-4-1)43-37-20-9-7-16-31(37)35-25-36-34-24-27(30-18-11-19-33-32-17-8-10-21-41(32)45-42(30)33)22-23-38(34)44(40(36)26-39(35)43)29-14-5-2-6-15-29;1-3-12-29(13-4-1)31-22-24-33(25-23-31)43-39-20-9-7-18-35(39)37-26-27-38-36-19-8-10-21-40(36)44(42(38)41(37)43)34-17-11-16-32(28-34)30-14-5-2-6-15-30;1-3-11-29(12-4-1)31-19-23-33(24-20-31)43-39-17-9-7-15-35(39)37-27-28-38-36-16-8-10-18-40(36)44(42(38)41(37)43)34-25-21-32(22-26-34)30-13-5-2-6-14-30/h1-27H;1-26H;2*1-28H |
| InChIKey | UHWFFRBCWUJSEX-UHFFFAOYSA-N |
| XLogP | 44.85 |
| TPSA | 57.51 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 10 |
| Rotatable Bonds | 14 |
| Heavy Atoms | 178 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2269.78 |
| LogP ≤ 5 | 44.85 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 10 |