C288H180N28 — CID 158675212
2-carbazol-9-yl-9-[2-carbazol-9-yl-4-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole;2-carbazol-9-yl-9-[2-carbazol-9-yl-5-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole;2-[9-[2-carbazol-9-yl-4-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[2-carbazol-9-yl-4-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazol-2-yl]-9-phenylcarbazole (PubChem CID 158675212) has the molecular formula C288H180N28 and a molecular weight of 4032.80 g/mol. Its IUPAC name is 2-carbazol-9-yl-9-[2-carbazol-9-yl-4-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole;2-carbazol-9-yl-9-[2-carbazol-9-yl-5-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole;2-[9-[2-carbazol-9-yl-4-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[2-carbazol-9-yl-4-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazol-2-yl]-9-phenylcarbazole.
| Compound Name | 2-carbazol-9-yl-9-[2-carbazol-9-yl-4-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole;2-carbazol-9-yl-9-[2-carbazol-9-yl-5-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole;2-[9-[2-carbazol-9-yl-4-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[2-carbazol-9-yl-4-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazol-2-yl]-9-phenylcarbazole |
|---|---|
| PubChem CID | 158675212 |
| Molecular Formula | C288H180N28 |
| Molecular Weight | 4032.80 g/mol |
| Exact Mass | 4029.49 |
| IUPAC Name | 2-carbazol-9-yl-9-[2-carbazol-9-yl-4-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole;2-carbazol-9-yl-9-[2-carbazol-9-yl-5-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole;2-[9-[2-carbazol-9-yl-4-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[2-carbazol-9-yl-4-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazol-2-yl]-9-phenylcarbazole |
| SMILES | c1ccc(-c2nc(-c3cccc(-n4c5ccccc5c5ccccc54)c3)nc(-c3ccc(-n4c5ccccc5c5cc(-c6ccc7c8ccccc8n(-c8ccccc8)c7c6)ccc54)c(-n4c5ccccc5c5ccccc54)c3)n2)cc1.c1ccc(-c2nc(-c3cccc(-n4c5ccccc5c5ccccc54)c3)nc(-c3ccc(-n4c5ccccc5c5ccc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)cc54)c(-n4c5ccccc5c5ccccc54)c3)n2)cc1.c1ccc(-c2nc(-c3cccc(-n4c5ccccc5c5ccccc54)c3)nc(-c3ccc(-n4c5ccccc5c5ccc(-n6c7ccccc7c7ccccc76)cc54)c(-n4c5ccccc5c5ccccc54)c3)n2)cc1.c1ccc(-c2nc(-c3cccc(-n4c5ccccc5c5ccccc54)c3)nc(-c3ccc(-n4c5ccccc5c5ccccc54)c(-n4c5ccccc5c5ccc(-n6c7ccccc7c7ccccc76)cc54)c3)n2)cc1 |
| InChI | InChI=1S/2C75H47N7.2C69H43N7/c1-3-20-48(21-4-1)73-76-74(51-22-19-25-54(44-51)80-64-33-14-7-26-55(64)56-27-8-15-34-65(56)80)78-75(77-73)52-40-43-70(72(47-52)82-66-35-16-10-28-57(66)58-29-11-17-36-67(58)82)81-68-37-18-12-31-60(68)62-45-49(39-42-69(62)81)50-38-41-61-59-30-9-13-32-63(59)79(71(61)46-50)53-23-5-2-6-24-53;1-3-20-48(21-4-1)73-76-74(51-22-19-25-54(44-51)80-63-32-13-7-26-55(63)56-27-8-14-33-64(56)80)78-75(77-73)52-40-43-70(72(47-52)81-66-35-16-9-28-57(66)58-29-10-17-36-67(58)81)82-68-37-18-11-30-59(68)61-41-38-50(46-71(61)82)49-39-42-69-62(45-49)60-31-12-15-34-65(60)79(69)53-23-5-2-6-24-53;1-2-19-44(20-3-1)67-70-68(45-21-18-22-47(41-45)73-57-30-11-4-23-49(57)50-24-5-12-31-58(50)73)72-69(71-67)46-37-40-64(66(42-46)75-61-34-15-8-27-53(61)54-28-9-16-35-62(54)75)76-63-36-17-10-29-55(63)56-39-38-48(43-65(56)76)74-59-32-13-6-25-51(59)52-26-7-14-33-60(52)74;1-2-19-44(20-3-1)67-70-68(45-21-18-22-47(41-45)73-57-30-11-4-23-49(57)50-24-5-12-31-58(50)73)72-69(71-67)46-37-40-64(75-61-34-15-8-27-53(61)54-28-9-16-35-62(54)75)66(42-46)76-63-36-17-10-29-55(63)56-39-38-48(43-65(56)76)74-59-32-13-6-25-51(59)52-26-7-14-33-60(52)74/h2*1-47H;2*1-43H |
| InChIKey | IEKTYVQHOGWRMW-UHFFFAOYSA-N |
| XLogP | 72.38 |
| TPSA | 233.56 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 28 |
| Rotatable Bonds | 30 |
| Heavy Atoms | 316 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 4032.80 |
| LogP ≤ 5 | 72.38 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 28 |