C207H132N18 — CID 158333834
3-[9-[2-carbazol-9-yl-4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[2-carbazol-9-yl-5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole;6-[2-carbazol-9-yl-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-9-phenyl-2-(9-phenylcarbazol-3-yl)carbazole (PubChem CID 158333834) has the molecular formula C207H132N18 and a molecular weight of 2871.46 g/mol. Its IUPAC name is 3-[9-[2-carbazol-9-yl-4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[2-carbazol-9-yl-5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole;6-[2-carbazol-9-yl-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-9-phenyl-2-(9-phenylcarbazol-3-yl)carbazole.
| Compound Name | 3-[9-[2-carbazol-9-yl-4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[2-carbazol-9-yl-5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole;6-[2-carbazol-9-yl-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-9-phenyl-2-(9-phenylcarbazol-3-yl)carbazole |
|---|---|
| PubChem CID | 158333834 |
| Molecular Formula | C207H132N18 |
| Molecular Weight | 2871.46 g/mol |
| Exact Mass | 2869.09 |
| IUPAC Name | 3-[9-[2-carbazol-9-yl-4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[2-carbazol-9-yl-5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole;6-[2-carbazol-9-yl-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-9-phenyl-2-(9-phenylcarbazol-3-yl)carbazole |
| SMILES | c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4ccc(-n5c6ccccc6c6cc(-c7ccc8c(c7)c7ccccc7n8-c7ccccc7)ccc65)c(-n5c6ccccc6c6ccccc65)c4)cc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)c(-n5c6ccccc6c6cc(-c7ccc8c(c7)c7ccccc7n8-c7ccccc7)ccc65)c4)cc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-n4c5ccccc5c5ccccc54)c(-c4ccc5c(c4)c4ccc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)cc4n5-c4ccccc4)c3)n2)cc1 |
| InChI | InChI=1S/3C69H44N6/c1-5-19-45(20-6-1)67-70-68(46-21-7-2-8-22-46)72-69(71-67)50-36-40-63(75-61-31-17-13-27-53(61)54-28-14-18-32-62(54)75)57(43-50)49-35-39-65-59(42-49)56-37-33-48(44-66(56)74(65)52-25-11-4-12-26-52)47-34-38-64-58(41-47)55-29-15-16-30-60(55)73(64)51-23-9-3-10-24-51;1-4-18-46(19-5-1)67-70-68(47-20-6-2-7-21-47)72-69(71-67)48-34-32-45(33-35-48)51-38-41-65(66(44-51)75-60-29-15-10-24-53(60)54-25-11-16-30-61(54)75)74-62-31-17-13-27-56(62)58-43-50(37-40-64(58)74)49-36-39-63-57(42-49)55-26-12-14-28-59(55)73(63)52-22-8-3-9-23-52;1-4-18-46(19-5-1)67-70-68(47-20-6-2-7-21-47)72-69(71-67)48-34-32-45(33-35-48)51-38-41-65(74-60-29-15-10-24-53(60)54-25-11-16-30-61(54)74)66(44-51)75-62-31-17-13-27-56(62)58-43-50(37-40-64(58)75)49-36-39-63-57(42-49)55-26-12-14-28-59(55)73(63)52-22-8-3-9-23-52/h3*1-44H |
| InChIKey | GQILBBOHQDEHCS-UHFFFAOYSA-N |
| XLogP | 52.49 |
| TPSA | 160.38 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 18 |
| Rotatable Bonds | 24 |
| Heavy Atoms | 225 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2871.46 |
| LogP ≤ 5 | 52.49 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 18 |