C208H136N16 — CID 158116203
11-(4,6-diphenyl-1,3,5-triazin-2-yl)-12,12-diphenylindeno[2,1-a]carbazole;11-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-12,12-diphenylindeno[2,1-a]carbazole;11-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-9,12,12-triphenylindeno[2,1-a]carbazole;11-(4,6-diphenyl-1,3,5-triazin-2-yl)-9,12,12-triphenylindeno[2,1-a]carbazole (PubChem CID 158116203) has the molecular formula C208H136N16 and a molecular weight of 2859.49 g/mol. Its IUPAC name is 11-(4,6-diphenyl-1,3,5-triazin-2-yl)-12,12-diphenylindeno[2,1-a]carbazole;11-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-12,12-diphenylindeno[2,1-a]carbazole;11-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-9,12,12-triphenylindeno[2,1-a]carbazole;11-(4,6-diphenyl-1,3,5-triazin-2-yl)-9,12,12-triphenylindeno[2,1-a]carbazole.
| Compound Name | 11-(4,6-diphenyl-1,3,5-triazin-2-yl)-12,12-diphenylindeno[2,1-a]carbazole;11-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-12,12-diphenylindeno[2,1-a]carbazole;11-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-9,12,12-triphenylindeno[2,1-a]carbazole;11-(4,6-diphenyl-1,3,5-triazin-2-yl)-9,12,12-triphenylindeno[2,1-a]carbazole |
|---|---|
| PubChem CID | 158116203 |
| Molecular Formula | C208H136N16 |
| Molecular Weight | 2859.49 g/mol |
| Exact Mass | 2857.11 |
| IUPAC Name | 11-(4,6-diphenyl-1,3,5-triazin-2-yl)-12,12-diphenylindeno[2,1-a]carbazole;11-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-12,12-diphenylindeno[2,1-a]carbazole;11-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-9,12,12-triphenylindeno[2,1-a]carbazole;11-(4,6-diphenyl-1,3,5-triazin-2-yl)-9,12,12-triphenylindeno[2,1-a]carbazole |
| SMILES | c1ccc(-c2ccc3c4ccc5c(c4n(-c4cccc(-c6nc(-c7ccccc7)nc(-c7ccccc7)n6)c4)c3c2)C(c2ccccc2)(c2ccccc2)c2ccccc2-5)cc1.c1ccc(-c2ccc3c4ccc5c(c4n(-c4nc(-c6ccccc6)nc(-c6ccccc6)n4)c3c2)C(c2ccccc2)(c2ccccc2)c2ccccc2-5)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-n4c5ccccc5c5ccc6c(c54)C(c4ccccc4)(c4ccccc4)c4ccccc4-6)c3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4c4ccc5c(c43)C(c3ccccc3)(c3ccccc3)c3ccccc3-5)n2)cc1 |
| InChI | InChI=1S/C58H38N4.2C52H34N4.C46H30N4/c1-6-19-39(20-7-1)42-33-34-48-50-36-35-49-47-31-16-17-32-51(47)58(44-26-12-4-13-27-44,45-28-14-5-15-29-45)53(49)54(50)62(52(48)38-42)46-30-18-25-43(37-46)57-60-55(40-21-8-2-9-22-40)59-56(61-57)41-23-10-3-11-24-41;1-6-18-35(19-7-1)38-30-31-42-44-33-32-43-41-28-16-17-29-45(41)52(39-24-12-4-13-25-39,40-26-14-5-15-27-40)47(43)48(44)56(46(42)34-38)51-54-49(36-20-8-2-9-21-36)53-50(55-51)37-22-10-3-11-23-37;1-5-18-35(19-6-1)49-53-50(36-20-7-2-8-21-36)55-51(54-49)37-22-17-27-40(34-37)56-46-31-16-14-29-42(46)44-33-32-43-41-28-13-15-30-45(41)52(47(43)48(44)56,38-23-9-3-10-24-38)39-25-11-4-12-26-39;1-5-17-31(18-6-1)43-47-44(32-19-7-2-8-20-32)49-45(48-43)50-40-28-16-14-26-36(40)38-30-29-37-35-25-13-15-27-39(35)46(41(37)42(38)50,33-21-9-3-10-22-33)34-23-11-4-12-24-34/h1-38H;2*1-34H;1-30H |
| InChIKey | FRAMYNUXAIQYAW-UHFFFAOYSA-N |
| XLogP | 49.33 |
| TPSA | 174.40 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 16 |
| Rotatable Bonds | 24 |
| Heavy Atoms | 224 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2859.49 |
| LogP ≤ 5 | 49.33 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 16 |