C188H122N24 — CID 158489068
3,6-di(carbazol-9-yl)-9-[4-[3,6-di(carbazol-9-yl)carbazol-9-yl]-6-phenyl-1,3,5-triazin-2-yl]carbazole;N,N-diphenyl-9-[4-[3-(N-phenylanilino)carbazol-9-yl]-6-pyridin-4-yl-1,3,5-triazin-2-yl]carbazol-3-amine;N,N-diphenyl-9-[4-[3-(N-phenylanilino)carbazol-9-yl]-1,3,5-triazin-2-yl]carbazol-3-amine (PubChem CID 158489068) has the molecular formula C188H122N24 and a molecular weight of 2717.21 g/mol. Its IUPAC name is 3,6-di(carbazol-9-yl)-9-[4-[3,6-di(carbazol-9-yl)carbazol-9-yl]-6-phenyl-1,3,5-triazin-2-yl]carbazole;N,N-diphenyl-9-[4-[3-(N-phenylanilino)carbazol-9-yl]-6-pyridin-4-yl-1,3,5-triazin-2-yl]carbazol-3-amine;N,N-diphenyl-9-[4-[3-(N-phenylanilino)carbazol-9-yl]-1,3,5-triazin-2-yl]carbazol-3-amine.
| Compound Name | 3,6-di(carbazol-9-yl)-9-[4-[3,6-di(carbazol-9-yl)carbazol-9-yl]-6-phenyl-1,3,5-triazin-2-yl]carbazole;N,N-diphenyl-9-[4-[3-(N-phenylanilino)carbazol-9-yl]-6-pyridin-4-yl-1,3,5-triazin-2-yl]carbazol-3-amine;N,N-diphenyl-9-[4-[3-(N-phenylanilino)carbazol-9-yl]-1,3,5-triazin-2-yl]carbazol-3-amine |
|---|---|
| PubChem CID | 158489068 |
| Molecular Formula | C188H122N24 |
| Molecular Weight | 2717.21 g/mol |
| Exact Mass | 2715.03 |
| IUPAC Name | 3,6-di(carbazol-9-yl)-9-[4-[3,6-di(carbazol-9-yl)carbazol-9-yl]-6-phenyl-1,3,5-triazin-2-yl]carbazole;N,N-diphenyl-9-[4-[3-(N-phenylanilino)carbazol-9-yl]-6-pyridin-4-yl-1,3,5-triazin-2-yl]carbazol-3-amine;N,N-diphenyl-9-[4-[3-(N-phenylanilino)carbazol-9-yl]-1,3,5-triazin-2-yl]carbazol-3-amine |
| SMILES | c1ccc(-c2nc(-n3c4ccc(-n5c6ccccc6c6ccccc65)cc4c4cc(-n5c6ccccc6c6ccccc65)ccc43)nc(-n3c4ccc(-n5c6ccccc6c6ccccc65)cc4c4cc(-n5c6ccccc6c6ccccc65)ccc43)n2)cc1.c1ccc(N(c2ccccc2)c2ccc3c(c2)c2ccccc2n3-c2nc(-c3ccncc3)nc(-n3c4ccccc4c4cc(N(c5ccccc5)c5ccccc5)ccc43)n2)cc1.c1ccc(N(c2ccccc2)c2ccc3c(c2)c2ccccc2n3-c2ncnc(-n3c4ccccc4c4cc(N(c5ccccc5)c5ccccc5)ccc43)n2)cc1 |
| InChI | InChI=1S/C81H49N9.C56H38N8.C51H35N7/c1-2-20-50(21-3-1)79-82-80(89-75-42-38-51(85-67-30-12-4-22-55(67)56-23-5-13-31-68(56)85)46-63(75)64-47-52(39-43-76(64)89)86-69-32-14-6-24-57(69)58-25-7-15-33-70(58)86)84-81(83-79)90-77-44-40-53(87-71-34-16-8-26-59(71)60-27-9-17-35-72(60)87)48-65(77)66-49-54(41-45-78(66)90)88-73-36-18-10-28-61(73)62-29-11-19-37-74(62)88;1-5-17-40(18-6-1)61(41-19-7-2-8-20-41)44-29-31-52-48(37-44)46-25-13-15-27-50(46)63(52)55-58-54(39-33-35-57-36-34-39)59-56(60-55)64-51-28-16-14-26-47(51)49-38-45(30-32-53(49)64)62(42-21-9-3-10-22-42)43-23-11-4-12-24-43;1-5-17-36(18-6-1)55(37-19-7-2-8-20-37)40-29-31-48-44(33-40)42-25-13-15-27-46(42)57(48)50-52-35-53-51(54-50)58-47-28-16-14-26-43(47)45-34-41(30-32-49(45)58)56(38-21-9-3-10-22-38)39-23-11-4-12-24-39/h1-49H;1-38H;1-35H |
| InChIKey | HILWEZJTSYALOL-UHFFFAOYSA-N |
| XLogP | 47.19 |
| TPSA | 191.16 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 24 |
| Rotatable Bonds | 24 |
| Heavy Atoms | 212 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2717.21 |
| LogP ≤ 5 | 47.19 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 24 |