C229H149N21O — CID 162262254
2-[2-[4-(9,9-diphenylfluoren-2-yl)phenyl]naphthalen-1-yl]-4,6-diphenyl-1,3,5-triazine;2-[2-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]naphthalen-1-yl]-4,6-diphenyl-1,3,5-triazine;2-[2-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]naphthalen-1-yl]-4,6-diphenyl-1,3,5-triazine;2-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]-1,3-benzoxazole;7-[4-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]phenyl]benzo[c]carbazole (PubChem CID 162262254) has the molecular formula C229H149N21O and a molecular weight of 3210.86 g/mol. Its IUPAC name is 2-[2-[4-(9,9-diphenylfluoren-2-yl)phenyl]naphthalen-1-yl]-4,6-diphenyl-1,3,5-triazine;2-[2-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]naphthalen-1-yl]-4,6-diphenyl-1,3,5-triazine;2-[2-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]naphthalen-1-yl]-4,6-diphenyl-1,3,5-triazine;2-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]-1,3-benzoxazole;7-[4-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]phenyl]benzo[c]carbazole.
| Compound Name | 2-[2-[4-(9,9-diphenylfluoren-2-yl)phenyl]naphthalen-1-yl]-4,6-diphenyl-1,3,5-triazine;2-[2-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]naphthalen-1-yl]-4,6-diphenyl-1,3,5-triazine;2-[2-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]naphthalen-1-yl]-4,6-diphenyl-1,3,5-triazine;2-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]-1,3-benzoxazole;7-[4-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]phenyl]benzo[c]carbazole |
|---|---|
| PubChem CID | 162262254 |
| Molecular Formula | C229H149N21O |
| Molecular Weight | 3210.86 g/mol |
| Exact Mass | 3208.23 |
| IUPAC Name | 2-[2-[4-(9,9-diphenylfluoren-2-yl)phenyl]naphthalen-1-yl]-4,6-diphenyl-1,3,5-triazine;2-[2-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]naphthalen-1-yl]-4,6-diphenyl-1,3,5-triazine;2-[2-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]naphthalen-1-yl]-4,6-diphenyl-1,3,5-triazine;2-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]-1,3-benzoxazole;7-[4-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]phenyl]benzo[c]carbazole |
| SMILES | c1ccc(-c2cc(-c3ccc(-c4ccc5ccccc5c4-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cc3)nc(-c3ccccc3)n2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-c3ccc(-c4ccc5ccccc5c4-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3c(-c4ccc(-c5ccc6c(c5)C(c5ccccc5)(c5ccccc5)c5ccccc5-6)cc4)ccc4ccccc34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3c(-c4ccc(-n5c6ccccc6c6c7ccccc7ccc65)cc4)ccc4ccccc34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3c(-c4nc5ccccc5o4)ccc4ccccc34)n2)cc1 |
| InChI | InChI=1S/C56H37N3.2C47H31N5.C47H30N4.C32H20N4O/c1-5-18-41(19-6-1)53-57-54(42-20-7-2-8-21-42)59-55(58-53)52-46-26-14-13-17-39(46)33-35-47(52)40-31-29-38(30-32-40)43-34-36-49-48-27-15-16-28-50(48)56(51(49)37-43,44-22-9-3-10-23-44)45-24-11-4-12-25-45;1-5-16-34(17-6-1)41-31-42(49-44(48-41)36-18-7-2-8-19-36)35-27-25-33(26-28-35)40-30-29-32-15-13-14-24-39(32)43(40)47-51-45(37-20-9-3-10-21-37)50-46(52-47)38-22-11-4-12-23-38;1-5-16-34(17-6-1)41-31-42(35-18-7-2-8-19-35)49-44(48-41)38-27-25-33(26-28-38)40-30-29-32-15-13-14-24-39(32)43(40)47-51-45(36-20-9-3-10-21-36)50-46(52-47)37-22-11-4-12-23-37;1-3-15-34(16-4-1)45-48-46(35-17-5-2-6-18-35)50-47(49-45)44-38-20-10-8-13-31(38)25-29-39(44)33-23-27-36(28-24-33)51-41-22-12-11-21-40(41)43-37-19-9-7-14-32(37)26-30-42(43)51;1-3-12-22(13-4-1)29-34-30(23-14-5-2-6-15-23)36-31(35-29)28-24-16-8-7-11-21(24)19-20-25(28)32-33-26-17-9-10-18-27(26)37-32/h1-37H;2*1-31H;1-30H;1-20H |
| InChIKey | ZZKICIOZZQHPPF-UHFFFAOYSA-N |
| XLogP | 56.47 |
| TPSA | 275.87 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 22 |
| Rotatable Bonds | 30 |
| Heavy Atoms | 251 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 3210.86 |
| LogP ≤ 5 | 56.47 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 22 |