C222H144N16 — CID 161194679
12-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-5-phenylindolo[3,2-c]carbazole;5-naphthalen-2-yl-12-[2-[6-phenyl-2-(2-phenylphenyl)pyrimidin-4-yl]phenyl]indolo[3,2-c]carbazole;12-[2-(2-naphthalen-1-yl-6-phenyl-4-pyridinyl)phenyl]-5-(2-phenylphenyl)indolo[3,2-c]carbazole;5-(3-phenylphenyl)-12-[2-[4-phenyl-6-(3-phenylphenyl)pyrimidin-2-yl]phenyl]indolo[3,2-c]carbazole (PubChem CID 161194679) has the molecular formula C222H144N16 and a molecular weight of 3035.71 g/mol. Its IUPAC name is 12-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-5-phenylindolo[3,2-c]carbazole;5-naphthalen-2-yl-12-[2-[6-phenyl-2-(2-phenylphenyl)pyrimidin-4-yl]phenyl]indolo[3,2-c]carbazole;12-[2-(2-naphthalen-1-yl-6-phenyl-4-pyridinyl)phenyl]-5-(2-phenylphenyl)indolo[3,2-c]carbazole;5-(3-phenylphenyl)-12-[2-[4-phenyl-6-(3-phenylphenyl)pyrimidin-2-yl]phenyl]indolo[3,2-c]carbazole.
| Compound Name | 12-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-5-phenylindolo[3,2-c]carbazole;5-naphthalen-2-yl-12-[2-[6-phenyl-2-(2-phenylphenyl)pyrimidin-4-yl]phenyl]indolo[3,2-c]carbazole;12-[2-(2-naphthalen-1-yl-6-phenyl-4-pyridinyl)phenyl]-5-(2-phenylphenyl)indolo[3,2-c]carbazole;5-(3-phenylphenyl)-12-[2-[4-phenyl-6-(3-phenylphenyl)pyrimidin-2-yl]phenyl]indolo[3,2-c]carbazole |
|---|---|
| PubChem CID | 161194679 |
| Molecular Formula | C222H144N16 |
| Molecular Weight | 3035.71 g/mol |
| Exact Mass | 3033.18 |
| IUPAC Name | 12-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-5-phenylindolo[3,2-c]carbazole;5-naphthalen-2-yl-12-[2-[6-phenyl-2-(2-phenylphenyl)pyrimidin-4-yl]phenyl]indolo[3,2-c]carbazole;12-[2-(2-naphthalen-1-yl-6-phenyl-4-pyridinyl)phenyl]-5-(2-phenylphenyl)indolo[3,2-c]carbazole;5-(3-phenylphenyl)-12-[2-[4-phenyl-6-(3-phenylphenyl)pyrimidin-2-yl]phenyl]indolo[3,2-c]carbazole |
| SMILES | c1ccc(-c2cc(-c3ccccc3-n3c4ccccc4c4ccc5c(c6ccccc6n5-c5ccc6ccccc6c5)c43)nc(-c3ccccc3-c3ccccc3)n2)cc1.c1ccc(-c2cc(-c3ccccc3-n3c4ccccc4c4ccc5c(c6ccccc6n5-c5ccccc5-c5ccccc5)c43)cc(-c3cccc4ccccc34)n2)cc1.c1ccc(-c2cccc(-c3cc(-c4ccccc4)nc(-c4ccccc4-n4c5ccccc5c5ccc6c(c7ccccc7n6-c6cccc(-c7ccccc7)c6)c54)n3)c2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-c4ccc(-n5c6ccccc6c6ccc7c(c8ccccc8n7-c7ccccc7)c65)cc4)c3)n2)cc1 |
| InChI | InChI=1S/C58H38N4.C57H37N3.C56H36N4.C51H33N5/c1-4-18-39(19-5-1)42-24-16-26-44(36-42)51-38-50(41-22-8-3-9-23-41)59-58(60-51)49-30-12-15-33-54(49)62-52-31-13-10-28-46(52)47-34-35-55-56(57(47)62)48-29-11-14-32-53(48)61(55)45-27-17-25-43(37-45)40-20-6-2-7-21-40;1-3-18-39(19-4-1)43-25-9-13-30-51(43)59-54-33-16-12-28-48(54)56-55(59)35-34-47-46-27-11-15-32-53(46)60(57(47)56)52-31-14-10-26-44(52)41-36-49(40-21-5-2-6-22-40)58-50(37-41)45-29-17-23-38-20-7-8-24-42(38)45;1-3-18-38(19-4-1)42-23-9-10-25-45(42)56-57-48(39-20-5-2-6-21-39)36-49(58-56)46-26-12-15-29-51(46)60-50-28-14-11-24-43(50)44-33-34-53-54(55(44)60)47-27-13-16-30-52(47)59(53)41-32-31-37-17-7-8-22-40(37)35-41;1-4-15-35(16-5-1)49-52-50(36-17-6-2-7-18-36)54-51(53-49)38-20-14-19-37(33-38)34-27-29-40(30-28-34)56-44-25-12-10-23-41(44)42-31-32-46-47(48(42)56)43-24-11-13-26-45(43)55(46)39-21-8-3-9-22-39/h1-38H;1-37H;1-36H;1-33H |
| InChIKey | UUEKWYWGWQLOSS-UHFFFAOYSA-N |
| XLogP | 57.33 |
| TPSA | 142.56 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 16 |
| Rotatable Bonds | 25 |
| Heavy Atoms | 238 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 3035.71 |
| LogP ≤ 5 | 57.33 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 16 |