C147H92N12O3 — CID 161252356
2-dibenzofuran-1-yl-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;2-dibenzofuran-1-yl-9-[3-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]carbazole;2-dibenzofuran-1-yl-9-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]carbazole (PubChem CID 161252356) has the molecular formula C147H92N12O3 and a molecular weight of 2074.43 g/mol. Its IUPAC name is 2-dibenzofuran-1-yl-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;2-dibenzofuran-1-yl-9-[3-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]carbazole;2-dibenzofuran-1-yl-9-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]carbazole.
| Compound Name | 2-dibenzofuran-1-yl-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;2-dibenzofuran-1-yl-9-[3-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]carbazole;2-dibenzofuran-1-yl-9-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]carbazole |
|---|---|
| PubChem CID | 161252356 |
| Molecular Formula | C147H92N12O3 |
| Molecular Weight | 2074.43 g/mol |
| Exact Mass | 2072.74 |
| IUPAC Name | 2-dibenzofuran-1-yl-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;2-dibenzofuran-1-yl-9-[3-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]carbazole;2-dibenzofuran-1-yl-9-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]carbazole |
| SMILES | c1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4cccc(-n5c6ccccc6c6ccc(-c7cccc8oc9ccccc9c78)cc65)c4)n3)cc2)cc1.c1ccc(-c2cccc(-c3nc(-c4ccccc4)nc(-c4cccc(-n5c6ccccc6c6ccc(-c7cccc8oc9ccccc9c78)cc65)c4)n3)c2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-n4c5ccccc5c5ccc(-c6cccc7oc8ccccc8c67)cc54)c3)n2)cc1 |
| InChI | InChI=1S/2C51H32N4O.C45H28N4O/c1-3-14-33(15-4-1)35-18-11-19-37(30-35)50-52-49(34-16-5-2-6-17-34)53-51(54-50)38-20-12-21-39(31-38)55-44-25-9-7-22-41(44)42-29-28-36(32-45(42)55)40-24-13-27-47-48(40)43-23-8-10-26-46(43)56-47;1-3-13-33(14-4-1)34-25-27-36(28-26-34)50-52-49(35-15-5-2-6-16-35)53-51(54-50)38-17-11-18-39(31-38)55-44-22-9-7-19-41(44)42-30-29-37(32-45(42)55)40-21-12-24-47-48(40)43-20-8-10-23-46(43)56-47;1-3-13-29(14-4-1)43-46-44(30-15-5-2-6-16-30)48-45(47-43)32-17-11-18-33(27-32)49-38-22-9-7-19-35(38)36-26-25-31(28-39(36)49)34-21-12-24-41-42(34)37-20-8-10-23-40(37)50-41/h2*1-32H;1-28H |
| InChIKey | VBKYYZNKJUBALL-UHFFFAOYSA-N |
| XLogP | 37.94 |
| TPSA | 170.22 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 15 |
| Rotatable Bonds | 17 |
| Heavy Atoms | 162 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2074.43 |
| LogP ≤ 5 | 37.94 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 15 |