C135H84N12O3 — CID 165084980
3-dibenzofuran-1-yl-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;3-dibenzofuran-1-yl-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;3-dibenzofuran-1-yl-9-[4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole (PubChem CID 165084980) has the molecular formula C135H84N12O3 and a molecular weight of 1922.24 g/mol. Its IUPAC name is 3-dibenzofuran-1-yl-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;3-dibenzofuran-1-yl-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;3-dibenzofuran-1-yl-9-[4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole.
| Compound Name | 3-dibenzofuran-1-yl-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;3-dibenzofuran-1-yl-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;3-dibenzofuran-1-yl-9-[4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole |
|---|---|
| PubChem CID | 165084980 |
| Molecular Formula | C135H84N12O3 |
| Molecular Weight | 1922.24 g/mol |
| Exact Mass | 1920.68 |
| IUPAC Name | 3-dibenzofuran-1-yl-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;3-dibenzofuran-1-yl-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;3-dibenzofuran-1-yl-9-[4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole |
| SMILES | c1ccc(-c2ccc(-c3nc(-c4cccc(-c5ccccc5)c4)nc(-n4c5ccccc5c5cc(-c6cccc7oc8ccccc8c67)ccc54)n3)cc2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccccc3-n3c4ccccc4c4cc(-c5cccc6oc7ccccc7c56)ccc43)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-c5cccc6oc7ccccc7c56)ccc43)n2)cc1 |
| InChI | InChI=1S/C51H32N4O.C45H28N4O.C39H24N4O/c1-3-13-33(14-4-1)35-25-27-36(28-26-35)49-52-50(39-18-11-17-37(31-39)34-15-5-2-6-16-34)54-51(53-49)55-44-22-9-7-19-41(44)43-32-38(29-30-45(43)55)40-21-12-24-47-48(40)42-20-8-10-23-46(42)56-47;1-3-14-29(15-4-1)43-46-44(30-16-5-2-6-17-30)48-45(47-43)34-19-8-11-23-38(34)49-37-22-10-7-18-33(37)36-28-31(26-27-39(36)49)32-21-13-25-41-42(32)35-20-9-12-24-40(35)50-41;1-3-12-25(13-4-1)37-40-38(26-14-5-2-6-15-26)42-39(41-37)43-32-19-9-7-16-29(32)31-24-27(22-23-33(31)43)28-18-11-21-35-36(28)30-17-8-10-20-34(30)44-35/h1-32H;1-28H;1-24H |
| InChIKey | VTASIUIZCFWRBO-UHFFFAOYSA-N |
| XLogP | 34.61 |
| TPSA | 170.22 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 15 |
| Rotatable Bonds | 15 |
| Heavy Atoms | 150 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 1922.24 |
| LogP ≤ 5 | 34.61 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 15 |