C312H204N24 — CID 161155963
2-[9-[4-(2,6-diphenyl-4-pyridinyl)phenyl]carbazol-3-yl]-9-phenylcarbazole;2-[9-[4-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-3-yl]-9-phenylcarbazole;2-[9-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]carbazol-3-yl]-9-phenylcarbazole;2-[9-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazol-3-yl]-9-phenylcarbazole;2-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-2-yl]-9-phenylcarbazole;2-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-3-yl]-9-phenylcarbazole (PubChem CID 161155963) has the molecular formula C312H204N24 and a molecular weight of 4289.23 g/mol. Its IUPAC name is 2-[9-[4-(2,6-diphenyl-4-pyridinyl)phenyl]carbazol-3-yl]-9-phenylcarbazole;2-[9-[4-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-3-yl]-9-phenylcarbazole;2-[9-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]carbazol-3-yl]-9-phenylcarbazole;2-[9-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazol-3-yl]-9-phenylcarbazole;2-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-2-yl]-9-phenylcarbazole;2-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-3-yl]-9-phenylcarbazole.
| Compound Name | 2-[9-[4-(2,6-diphenyl-4-pyridinyl)phenyl]carbazol-3-yl]-9-phenylcarbazole;2-[9-[4-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-3-yl]-9-phenylcarbazole;2-[9-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]carbazol-3-yl]-9-phenylcarbazole;2-[9-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazol-3-yl]-9-phenylcarbazole;2-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-2-yl]-9-phenylcarbazole;2-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-3-yl]-9-phenylcarbazole |
|---|---|
| PubChem CID | 161155963 |
| Molecular Formula | C312H204N24 |
| Molecular Weight | 4289.23 g/mol |
| Exact Mass | 4285.67 |
| IUPAC Name | 2-[9-[4-(2,6-diphenyl-4-pyridinyl)phenyl]carbazol-3-yl]-9-phenylcarbazole;2-[9-[4-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-3-yl]-9-phenylcarbazole;2-[9-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]carbazol-3-yl]-9-phenylcarbazole;2-[9-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazol-3-yl]-9-phenylcarbazole;2-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-2-yl]-9-phenylcarbazole;2-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-3-yl]-9-phenylcarbazole |
| SMILES | c1ccc(-c2cc(-c3ccc(-n4c5ccccc5c5cc(-c6ccc7c8ccccc8n(-c8ccccc8)c7c6)ccc54)cc3)cc(-c3ccccc3)n2)cc1.c1ccc(-c2cc(-c3ccc(-n4c5ccccc5c5cc(-c6ccc7c8ccccc8n(-c8ccccc8)c7c6)ccc54)cc3)nc(-c3ccccc3)n2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-c3ccc(-n4c5ccccc5c5cc(-c6ccc7c8ccccc8n(-c8ccccc8)c7c6)ccc54)cc3)c2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-c3ccc(-n4c5ccccc5c5cc(-c6ccc7c8ccccc8n(-c8ccccc8)c7c6)ccc54)cc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-n4c5ccccc5c5cc(-c6ccc7c8ccccc8n(-c8ccccc8)c7c6)ccc54)cc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-n4c5ccccc5c5ccc(-c6ccc7c8ccccc8n(-c8ccccc8)c7c6)cc54)cc3)n2)cc1 |
| InChI | InChI=1S/2C53H35N3.2C52H34N4.2C51H33N5/c1-4-14-37(15-5-1)48-33-41(34-49(54-48)38-16-6-2-7-17-38)36-24-28-43(29-25-36)55-51-23-13-11-21-45(51)47-32-39(27-31-52(47)55)40-26-30-46-44-20-10-12-22-50(44)56(53(46)35-40)42-18-8-3-9-19-42;1-4-14-36(15-5-1)41-33-48(37-16-6-2-7-17-37)54-49(34-41)38-24-28-43(29-25-38)55-51-23-13-11-21-45(51)47-32-39(27-31-52(47)55)40-26-30-46-44-20-10-12-22-50(44)56(53(46)35-40)42-18-8-3-9-19-42;1-4-14-35(15-5-1)46-34-47(54-52(53-46)37-16-6-2-7-17-37)36-24-28-41(29-25-36)55-49-23-13-11-21-43(49)45-32-38(27-31-50(45)55)39-26-30-44-42-20-10-12-22-48(42)56(51(44)33-39)40-18-8-3-9-19-40;1-4-14-35(15-5-1)46-34-47(36-16-6-2-7-17-36)54-52(53-46)37-24-28-41(29-25-37)55-49-23-13-11-21-43(49)45-32-38(27-31-50(45)55)39-26-30-44-42-20-10-12-22-48(42)56(51(44)33-39)40-18-8-3-9-19-40;1-4-14-34(15-5-1)49-52-50(35-16-6-2-7-17-35)54-51(53-49)36-24-28-40(29-25-36)55-46-23-13-11-21-42(46)44-32-37(27-31-47(44)55)38-26-30-43-41-20-10-12-22-45(41)56(48(43)33-38)39-18-8-3-9-19-39;1-4-14-34(15-5-1)49-52-50(35-16-6-2-7-17-35)54-51(53-49)36-24-28-40(29-25-36)56-46-23-13-11-21-42(46)44-31-27-38(33-48(44)56)37-26-30-43-41-20-10-12-22-45(41)55(47(43)32-37)39-18-8-3-9-19-39/h2*1-35H;2*1-34H;2*1-33H |
| InChIKey | UPHICWAAMSQESC-UHFFFAOYSA-N |
| XLogP | 80.03 |
| TPSA | 213.84 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 24 |
| Rotatable Bonds | 36 |
| Heavy Atoms | 336 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 4289.23 |
| LogP ≤ 5 | 80.03 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 24 |