C153H93N15O3 — CID 159951134
9-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-2-dibenzofuran-1-ylcarbazole;2-dibenzofuran-1-yl-9-[4-phenyl-6-(9-phenylcarbazol-2-yl)-1,3,5-triazin-2-yl]carbazole;2-dibenzofuran-1-yl-9-[4-phenyl-6-(9-phenylcarbazol-3-yl)-1,3,5-triazin-2-yl]carbazole (PubChem CID 159951134) has the molecular formula C153H93N15O3 and a molecular weight of 2189.53 g/mol. Its IUPAC name is 9-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-2-dibenzofuran-1-ylcarbazole;2-dibenzofuran-1-yl-9-[4-phenyl-6-(9-phenylcarbazol-2-yl)-1,3,5-triazin-2-yl]carbazole;2-dibenzofuran-1-yl-9-[4-phenyl-6-(9-phenylcarbazol-3-yl)-1,3,5-triazin-2-yl]carbazole.
| Compound Name | 9-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-2-dibenzofuran-1-ylcarbazole;2-dibenzofuran-1-yl-9-[4-phenyl-6-(9-phenylcarbazol-2-yl)-1,3,5-triazin-2-yl]carbazole;2-dibenzofuran-1-yl-9-[4-phenyl-6-(9-phenylcarbazol-3-yl)-1,3,5-triazin-2-yl]carbazole |
|---|---|
| PubChem CID | 159951134 |
| Molecular Formula | C153H93N15O3 |
| Molecular Weight | 2189.53 g/mol |
| Exact Mass | 2187.76 |
| IUPAC Name | 9-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-2-dibenzofuran-1-ylcarbazole;2-dibenzofuran-1-yl-9-[4-phenyl-6-(9-phenylcarbazol-2-yl)-1,3,5-triazin-2-yl]carbazole;2-dibenzofuran-1-yl-9-[4-phenyl-6-(9-phenylcarbazol-3-yl)-1,3,5-triazin-2-yl]carbazole |
| SMILES | c1ccc(-c2nc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)nc(-n3c4ccccc4c4ccc(-c5cccc6oc7ccccc7c56)cc43)n2)cc1.c1ccc(-c2nc(-c3ccc4c5ccccc5n(-c5ccccc5)c4c3)nc(-n3c4ccccc4c4ccc(-c5cccc6oc7ccccc7c56)cc43)n2)cc1.c1ccc(-c2nc(-c3cccc(-n4c5ccccc5c5ccccc54)c3)nc(-n3c4ccccc4c4ccc(-c5cccc6oc7ccccc7c56)cc43)n2)cc1 |
| InChI | InChI=1S/3C51H31N5O/c1-3-14-32(15-4-1)49-52-50(34-27-29-44-41(30-34)38-19-8-10-22-42(38)55(44)35-16-5-2-6-17-35)54-51(53-49)56-43-23-11-7-18-37(43)39-28-26-33(31-45(39)56)36-21-13-25-47-48(36)40-20-9-12-24-46(40)57-47;1-3-14-32(15-4-1)49-52-50(34-27-29-39-37-18-7-10-22-42(37)55(44(39)31-34)35-16-5-2-6-17-35)54-51(53-49)56-43-23-11-8-19-38(43)40-28-26-33(30-45(40)56)36-21-13-25-47-48(36)41-20-9-12-24-46(41)57-47;1-2-14-32(15-3-1)49-52-50(34-16-12-17-35(30-34)55-42-23-8-4-18-37(42)38-19-5-9-24-43(38)55)54-51(53-49)56-44-25-10-6-20-39(44)40-29-28-33(31-45(40)56)36-22-13-27-47-48(36)41-21-7-11-26-46(41)57-47/h3*1-31H |
| InChIKey | OCCZKVPQFCTMGH-UHFFFAOYSA-N |
| XLogP | 38.90 |
| TPSA | 185.01 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 18 |
| Rotatable Bonds | 15 |
| Heavy Atoms | 171 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2189.53 |
| LogP ≤ 5 | 38.90 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 18 |