C274H172N38 — CID 158425308
11,12-dipyridin-2-ylindolo[2,3-a]carbazole;11,12-di(pyrimidin-2-yl)indolo[2,3-a]carbazole;11-phenyl-12-[5-(11-phenylindolo[2,3-a]carbazol-12-yl)naphthalen-1-yl]indolo[2,3-a]carbazole;11-phenyl-12-[6-(11-phenylindolo[2,3-a]carbazol-12-yl)-2-pyridinyl]indolo[2,3-a]carbazole;11-phenyl-12-pyrimidin-2-ylindolo[2,3-a]carbazole;11-phenyl-12-(1,3,5-triazin-2-yl)indolo[2,3-a]carbazole;11-pyridin-2-yl-12-pyrimidin-2-ylindolo[2,3-a]carbazole;12-pyridin-2-yl-11-pyrimidin-4-ylindolo[2,3-a]carbazole (PubChem CID 158425308) has the molecular formula C274H172N38 and a molecular weight of 3996.66 g/mol. Its IUPAC name is 11,12-dipyridin-2-ylindolo[2,3-a]carbazole;11,12-di(pyrimidin-2-yl)indolo[2,3-a]carbazole;11-phenyl-12-[5-(11-phenylindolo[2,3-a]carbazol-12-yl)naphthalen-1-yl]indolo[2,3-a]carbazole;11-phenyl-12-[6-(11-phenylindolo[2,3-a]carbazol-12-yl)-2-pyridinyl]indolo[2,3-a]carbazole;11-phenyl-12-pyrimidin-2-ylindolo[2,3-a]carbazole;11-phenyl-12-(1,3,5-triazin-2-yl)indolo[2,3-a]carbazole;11-pyridin-2-yl-12-pyrimidin-2-ylindolo[2,3-a]carbazole;12-pyridin-2-yl-11-pyrimidin-4-ylindolo[2,3-a]carbazole.
| Compound Name | 11,12-dipyridin-2-ylindolo[2,3-a]carbazole;11,12-di(pyrimidin-2-yl)indolo[2,3-a]carbazole;11-phenyl-12-[5-(11-phenylindolo[2,3-a]carbazol-12-yl)naphthalen-1-yl]indolo[2,3-a]carbazole;11-phenyl-12-[6-(11-phenylindolo[2,3-a]carbazol-12-yl)-2-pyridinyl]indolo[2,3-a]carbazole;11-phenyl-12-pyrimidin-2-ylindolo[2,3-a]carbazole;11-phenyl-12-(1,3,5-triazin-2-yl)indolo[2,3-a]carbazole;11-pyridin-2-yl-12-pyrimidin-2-ylindolo[2,3-a]carbazole;12-pyridin-2-yl-11-pyrimidin-4-ylindolo[2,3-a]carbazole |
|---|---|
| PubChem CID | 158425308 |
| Molecular Formula | C274H172N38 |
| Molecular Weight | 3996.66 g/mol |
| Exact Mass | 3993.46 |
| IUPAC Name | 11,12-dipyridin-2-ylindolo[2,3-a]carbazole;11,12-di(pyrimidin-2-yl)indolo[2,3-a]carbazole;11-phenyl-12-[5-(11-phenylindolo[2,3-a]carbazol-12-yl)naphthalen-1-yl]indolo[2,3-a]carbazole;11-phenyl-12-[6-(11-phenylindolo[2,3-a]carbazol-12-yl)-2-pyridinyl]indolo[2,3-a]carbazole;11-phenyl-12-pyrimidin-2-ylindolo[2,3-a]carbazole;11-phenyl-12-(1,3,5-triazin-2-yl)indolo[2,3-a]carbazole;11-pyridin-2-yl-12-pyrimidin-2-ylindolo[2,3-a]carbazole;12-pyridin-2-yl-11-pyrimidin-4-ylindolo[2,3-a]carbazole |
| SMILES | c1ccc(-n2c3ccccc3c3ccc4c5ccccc5n(-c5cccc(-n6c7ccccc7c7ccc8c9ccccc9n(-c9ccccc9)c8c76)n5)c4c32)cc1.c1ccc(-n2c3ccccc3c3ccc4c5ccccc5n(-c5cccc6c(-n7c8ccccc8c8ccc9c%10ccccc%10n(-c%10ccccc%10)c9c87)cccc56)c4c32)cc1.c1ccc(-n2c3ccccc3c3ccc4c5ccccc5n(-c5ccccn5)c4c32)nc1.c1ccc(-n2c3ccccc3c3ccc4c5ccccc5n(-c5ccncn5)c4c32)nc1.c1ccc(-n2c3ccccc3c3ccc4c5ccccc5n(-c5ncccn5)c4c32)cc1.c1ccc(-n2c3ccccc3c3ccc4c5ccccc5n(-c5ncccn5)c4c32)nc1.c1ccc(-n2c3ccccc3c3ccc4c5ccccc5n(-c5ncncn5)c4c32)cc1.c1cnc(-n2c3ccccc3c3ccc4c5ccccc5n(-c5ncccn5)c4c32)nc1 |
| InChI | InChI=1S/C58H36N4.C53H33N5.2C28H18N4.3C27H17N5.C26H16N6/c1-3-17-37(18-4-1)59-49-27-11-7-21-41(49)45-33-35-47-43-23-9-13-29-51(43)61(57(47)55(45)59)53-31-15-26-40-39(53)25-16-32-54(40)62-52-30-14-10-24-44(52)48-36-34-46-42-22-8-12-28-50(42)60(56(46)58(48)62)38-19-5-2-6-20-38;1-3-16-34(17-4-1)55-44-24-11-7-20-36(44)40-30-32-42-38-22-9-13-26-46(38)57(52(42)50(40)55)48-28-15-29-49(54-48)58-47-27-14-10-23-39(47)43-33-31-41-37-21-8-12-25-45(37)56(51(41)53(43)58)35-18-5-2-6-19-35;1-3-11-23-19(9-1)21-15-16-22-20-10-2-4-12-24(20)32(26-14-6-8-18-30-26)28(22)27(21)31(23)25-13-5-7-17-29-25;1-2-9-19(10-3-1)31-24-13-6-4-11-20(24)22-15-16-23-21-12-5-7-14-25(21)32(27(23)26(22)31)28-29-17-8-18-30-28;1-3-10-22-18(8-1)20-13-14-21-19-9-2-4-11-23(19)32(27-29-16-7-17-30-27)26(21)25(20)31(22)24-12-5-6-15-28-24;1-3-9-22-18(7-1)20-12-13-21-19-8-2-4-10-23(19)32(25-14-16-28-17-30-25)27(21)26(20)31(22)24-11-5-6-15-29-24;1-2-8-18(9-3-1)31-23-12-6-4-10-19(23)21-14-15-22-20-11-5-7-13-24(20)32(26(22)25(21)31)27-29-16-28-17-30-27;1-3-9-21-17(7-1)19-11-12-20-18-8-2-4-10-22(18)32(26-29-15-6-16-30-26)24(20)23(19)31(21)25-27-13-5-14-28-25/h1-36H;1-33H;2*1-18H;3*1-17H;1-16H |
| InChIKey | HAZALWAQBLMZBM-UHFFFAOYSA-N |
| XLogP | 65.70 |
| TPSA | 330.62 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 38 |
| Rotatable Bonds | 20 |
| Heavy Atoms | 312 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 3996.66 |
| LogP ≤ 5 | 65.70 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 38 |