C133H88N8O — CID 158881959
12-(4-carbazol-9-ylphenyl)-11-phenylindolo[2,3-a]carbazole;12-(4-dibenzofuran-4-ylphenyl)-11-phenylindolo[2,3-a]carbazole;11,12-diphenyl-3-(9-phenylcarbazol-3-yl)indolo[2,3-a]carbazole;methane (PubChem CID 158881959) has the molecular formula C133H88N8O and a molecular weight of 1814.22 g/mol. Its IUPAC name is 12-(4-carbazol-9-ylphenyl)-11-phenylindolo[2,3-a]carbazole;12-(4-dibenzofuran-4-ylphenyl)-11-phenylindolo[2,3-a]carbazole;11,12-diphenyl-3-(9-phenylcarbazol-3-yl)indolo[2,3-a]carbazole;methane.
| Compound Name | 12-(4-carbazol-9-ylphenyl)-11-phenylindolo[2,3-a]carbazole;12-(4-dibenzofuran-4-ylphenyl)-11-phenylindolo[2,3-a]carbazole;11,12-diphenyl-3-(9-phenylcarbazol-3-yl)indolo[2,3-a]carbazole;methane |
|---|---|
| PubChem CID | 158881959 |
| Molecular Formula | C133H88N8O |
| Molecular Weight | 1814.22 g/mol |
| Exact Mass | 1812.71 |
| IUPAC Name | 12-(4-carbazol-9-ylphenyl)-11-phenylindolo[2,3-a]carbazole;12-(4-dibenzofuran-4-ylphenyl)-11-phenylindolo[2,3-a]carbazole;11,12-diphenyl-3-(9-phenylcarbazol-3-yl)indolo[2,3-a]carbazole;methane |
| SMILES | C.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccc6c7ccccc7n(-c7ccccc7)c6c4n5-c4ccccc4)ccc32)cc1.c1ccc(-n2c3ccccc3c3ccc4c5ccccc5n(-c5ccc(-c6cccc7c6oc6ccccc67)cc5)c4c32)cc1.c1ccc(-n2c3ccccc3c3ccc4c5ccccc5n(-c5ccc(-n6c7ccccc7c7ccccc76)cc5)c4c32)cc1 |
| InChI | InChI=1S/C48H31N3.C42H27N3.C42H26N2O.CH4/c1-4-14-34(15-5-1)49-43-22-12-11-21-38(43)41-30-32(24-28-45(41)49)33-25-29-46-42(31-33)40-27-26-39-37-20-10-13-23-44(37)50(35-16-6-2-7-17-35)47(39)48(40)51(46)36-18-8-3-9-19-36;1-2-12-28(13-3-1)44-39-20-10-6-16-33(39)35-26-27-36-34-17-7-11-21-40(34)45(42(36)41(35)44)30-24-22-29(23-25-30)43-37-18-8-4-14-31(37)32-15-5-9-19-38(32)43;1-2-11-28(12-3-1)43-37-18-7-4-13-31(37)34-25-26-35-32-14-5-8-19-38(32)44(41(35)40(34)43)29-23-21-27(22-24-29)30-16-10-17-36-33-15-6-9-20-39(33)45-42(30)36;/h1-31H;1-27H;1-26H;1H4 |
| InChIKey | JDDFRRKAPBHHOB-UHFFFAOYSA-N |
| XLogP | 35.71 |
| TPSA | 52.58 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 9 |
| Rotatable Bonds | 10 |
| Heavy Atoms | 142 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 1814.22 |
| LogP ≤ 5 | 35.71 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 9 |