C318H196N20O6 — CID 159620687
9-[3-[4-(4-phenylphenyl)-6-spiro[fluorene-9,9'-xanthene]-1-yl-1,3,5-triazin-2-yl]phenyl]carbazole;9-[4-(2-phenyl-6-spiro[fluorene-9,9'-xanthene]-1-ylpyrimidin-4-yl)phenyl]carbazole;9-[4-(6-phenyl-2-spiro[fluorene-9,9'-xanthene]-1-ylpyrimidin-4-yl)phenyl]carbazole;9-[4-(4-phenyl-6-spiro[fluorene-9,9'-xanthene]-1-yl-1,3,5-triazin-2-yl)phenyl]carbazole;9-[3-(2-spiro[fluorene-9,9'-xanthene]-1-ylquinazolin-4-yl)phenyl]carbazole;9-[4-(4-spiro[fluorene-9,9'-xanthene]-1-ylquinazolin-2-yl)phenyl]carbazole (PubChem CID 159620687) has the molecular formula C318H196N20O6 and a molecular weight of 4393.20 g/mol. Its IUPAC name is 9-[3-[4-(4-phenylphenyl)-6-spiro[fluorene-9,9'-xanthene]-1-yl-1,3,5-triazin-2-yl]phenyl]carbazole;9-[4-(2-phenyl-6-spiro[fluorene-9,9'-xanthene]-1-ylpyrimidin-4-yl)phenyl]carbazole;9-[4-(6-phenyl-2-spiro[fluorene-9,9'-xanthene]-1-ylpyrimidin-4-yl)phenyl]carbazole;9-[4-(4-phenyl-6-spiro[fluorene-9,9'-xanthene]-1-yl-1,3,5-triazin-2-yl)phenyl]carbazole;9-[3-(2-spiro[fluorene-9,9'-xanthene]-1-ylquinazolin-4-yl)phenyl]carbazole;9-[4-(4-spiro[fluorene-9,9'-xanthene]-1-ylquinazolin-2-yl)phenyl]carbazole.
| Compound Name | 9-[3-[4-(4-phenylphenyl)-6-spiro[fluorene-9,9'-xanthene]-1-yl-1,3,5-triazin-2-yl]phenyl]carbazole;9-[4-(2-phenyl-6-spiro[fluorene-9,9'-xanthene]-1-ylpyrimidin-4-yl)phenyl]carbazole;9-[4-(6-phenyl-2-spiro[fluorene-9,9'-xanthene]-1-ylpyrimidin-4-yl)phenyl]carbazole;9-[4-(4-phenyl-6-spiro[fluorene-9,9'-xanthene]-1-yl-1,3,5-triazin-2-yl)phenyl]carbazole;9-[3-(2-spiro[fluorene-9,9'-xanthene]-1-ylquinazolin-4-yl)phenyl]carbazole;9-[4-(4-spiro[fluorene-9,9'-xanthene]-1-ylquinazolin-2-yl)phenyl]carbazole |
|---|---|
| PubChem CID | 159620687 |
| Molecular Formula | C318H196N20O6 |
| Molecular Weight | 4393.20 g/mol |
| Exact Mass | 4389.56 |
| IUPAC Name | 9-[3-[4-(4-phenylphenyl)-6-spiro[fluorene-9,9'-xanthene]-1-yl-1,3,5-triazin-2-yl]phenyl]carbazole;9-[4-(2-phenyl-6-spiro[fluorene-9,9'-xanthene]-1-ylpyrimidin-4-yl)phenyl]carbazole;9-[4-(6-phenyl-2-spiro[fluorene-9,9'-xanthene]-1-ylpyrimidin-4-yl)phenyl]carbazole;9-[4-(4-phenyl-6-spiro[fluorene-9,9'-xanthene]-1-yl-1,3,5-triazin-2-yl)phenyl]carbazole;9-[3-(2-spiro[fluorene-9,9'-xanthene]-1-ylquinazolin-4-yl)phenyl]carbazole;9-[4-(4-spiro[fluorene-9,9'-xanthene]-1-ylquinazolin-2-yl)phenyl]carbazole |
| SMILES | c1cc(-c2nc(-c3cccc4c3C3(c5ccccc5Oc5ccccc53)c3ccccc3-4)nc3ccccc23)cc(-n2c3ccccc3c3ccccc32)c1.c1ccc(-c2cc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)nc(-c3cccc4c3C3(c5ccccc5Oc5ccccc53)c3ccccc3-4)n2)cc1.c1ccc(-c2ccc(-c3nc(-c4cccc(-n5c6ccccc6c6ccccc65)c4)nc(-c4cccc5c4C4(c6ccccc6Oc6ccccc64)c4ccccc4-5)n3)cc2)cc1.c1ccc(-c2nc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)cc(-c3cccc4c3C3(c5ccccc5Oc5ccccc53)c3ccccc3-4)n2)cc1.c1ccc(-c2nc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)nc(-c3cccc4c3C3(c5ccccc5Oc5ccccc53)c3ccccc3-4)n2)cc1.c1ccc2c(c1)Oc1ccccc1C21c2ccccc2-c2cccc(-c3nc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)nc4ccccc34)c21 |
| InChI | InChI=1S/C58H36N4O.2C53H33N3O.C52H32N4O.2C51H31N3O/c1-2-16-37(17-3-1)38-32-34-39(35-33-38)55-59-56(40-18-14-19-41(36-40)62-50-28-10-5-21-43(50)44-22-6-11-29-51(44)62)61-57(60-55)46-24-15-23-45-42-20-4-7-25-47(42)58(54(45)46)48-26-8-12-30-52(48)63-53-31-13-9-27-49(53)58;1-2-15-35(16-3-1)52-54-45(34-29-31-36(32-30-34)56-47-25-10-5-18-38(47)39-19-6-11-26-48(39)56)33-46(55-52)41-21-14-20-40-37-17-4-7-22-42(37)53(51(40)41)43-23-8-12-27-49(43)57-50-28-13-9-24-44(50)53;1-2-15-34(16-3-1)45-33-46(35-29-31-36(32-30-35)56-47-25-10-5-18-38(47)39-19-6-11-26-48(39)56)55-52(54-45)41-21-14-20-40-37-17-4-7-22-42(37)53(51(40)41)43-23-8-12-27-49(43)57-50-28-13-9-24-44(50)53;1-2-15-33(16-3-1)49-53-50(34-29-31-35(32-30-34)56-44-25-10-5-18-37(44)38-19-6-11-26-45(38)56)55-51(54-49)40-21-14-20-39-36-17-4-7-22-41(36)52(48(39)40)42-23-8-12-27-46(42)57-47-28-13-9-24-43(47)52;1-5-23-40-34(17-1)37-21-14-22-39(48(37)51(40)41-24-6-11-29-46(41)55-47-30-12-7-25-42(47)51)50-52-43-26-8-2-20-38(43)49(53-50)32-15-13-16-33(31-32)54-44-27-9-3-18-35(44)36-19-4-10-28-45(36)54;1-5-20-40-34(14-1)37-18-13-19-39(48(37)51(40)41-21-6-11-26-46(41)55-47-27-12-7-22-42(47)51)49-38-17-2-8-23-43(38)52-50(53-49)32-28-30-33(31-29-32)54-44-24-9-3-15-35(44)36-16-4-10-25-45(36)54/h1-36H;2*1-33H;1-32H;2*1-31H |
| InChIKey | MNVNYQGWFIZUNG-UHFFFAOYSA-N |
| XLogP | 77.69 |
| TPSA | 265.42 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 26 |
| Rotatable Bonds | 23 |
| Heavy Atoms | 344 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 4393.20 |
| LogP ≤ 5 | 77.69 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 26 |