C192H132N22O — CID 158393414
2-(4-tert-butylphenyl)-5-[4-[4-(3,4-diphenylimidazo[4,5-c]quinolin-2-yl)phenyl]phenyl]-1,3,4-oxadiazole;2-[4-[4-(2,5-diphenylimidazol-1-yl)phenyl]phenyl]-3,4-diphenylimidazo[4,5-c]quinoline;2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-3,4-diphenylimidazo[4,5-c]quinoline;2-[4-[4-(4,5-diphenyl-1,2,4-triazol-3-yl)phenyl]phenyl]-3,4-diphenylimidazo[4,5-c]quinoline (PubChem CID 158393414) has the molecular formula C192H132N22O and a molecular weight of 2763.32 g/mol. Its IUPAC name is 2-(4-tert-butylphenyl)-5-[4-[4-(3,4-diphenylimidazo[4,5-c]quinolin-2-yl)phenyl]phenyl]-1,3,4-oxadiazole;2-[4-[4-(2,5-diphenylimidazol-1-yl)phenyl]phenyl]-3,4-diphenylimidazo[4,5-c]quinoline;2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-3,4-diphenylimidazo[4,5-c]quinoline;2-[4-[4-(4,5-diphenyl-1,2,4-triazol-3-yl)phenyl]phenyl]-3,4-diphenylimidazo[4,5-c]quinoline.
| Compound Name | 2-(4-tert-butylphenyl)-5-[4-[4-(3,4-diphenylimidazo[4,5-c]quinolin-2-yl)phenyl]phenyl]-1,3,4-oxadiazole;2-[4-[4-(2,5-diphenylimidazol-1-yl)phenyl]phenyl]-3,4-diphenylimidazo[4,5-c]quinoline;2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-3,4-diphenylimidazo[4,5-c]quinoline;2-[4-[4-(4,5-diphenyl-1,2,4-triazol-3-yl)phenyl]phenyl]-3,4-diphenylimidazo[4,5-c]quinoline |
|---|---|
| PubChem CID | 158393414 |
| Molecular Formula | C192H132N22O |
| Molecular Weight | 2763.32 g/mol |
| Exact Mass | 2761.10 |
| IUPAC Name | 2-(4-tert-butylphenyl)-5-[4-[4-(3,4-diphenylimidazo[4,5-c]quinolin-2-yl)phenyl]phenyl]-1,3,4-oxadiazole;2-[4-[4-(2,5-diphenylimidazol-1-yl)phenyl]phenyl]-3,4-diphenylimidazo[4,5-c]quinoline;2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-3,4-diphenylimidazo[4,5-c]quinoline;2-[4-[4-(4,5-diphenyl-1,2,4-triazol-3-yl)phenyl]phenyl]-3,4-diphenylimidazo[4,5-c]quinoline |
| SMILES | CC(C)(C)c1ccc(-c2nnc(-c3ccc(-c4ccc(-c5nc6c7ccccc7nc(-c7ccccc7)c6n5-c5ccccc5)cc4)cc3)o2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4ccc(-c5nc6c7ccccc7nc(-c7ccccc7)c6n5-c5ccccc5)cc4)cc3)n2)cc1.c1ccc(-c2nc3ccccc3c3nc(-c4ccc(-c5ccc(-c6nnc(-c7ccccc7)n6-c6ccccc6)cc5)cc4)n(-c4ccccc4)c23)cc1.c1ccc(-c2nc3ccccc3c3nc(-c4ccc(-c5ccc(-n6c(-c7ccccc7)cnc6-c6ccccc6)cc5)cc4)n(-c4ccccc4)c23)cc1 |
| InChI | InChI=1S/C49H32N6.C49H33N5.C48H32N6.C46H35N5O/c1-5-15-35(16-6-1)43-45-44(41-23-13-14-24-42(41)50-43)51-49(55(45)40-21-11-4-12-22-40)39-31-27-34(28-32-39)33-25-29-38(30-26-33)48-53-46(36-17-7-2-8-18-36)52-47(54-48)37-19-9-3-10-20-37;1-5-15-36(16-6-1)44-33-50-48(38-19-9-3-10-20-38)53(44)41-31-29-35(30-32-41)34-25-27-39(28-26-34)49-52-46-42-23-13-14-24-43(42)51-45(37-17-7-2-8-18-37)47(46)54(49)40-21-11-4-12-22-40;1-5-15-35(16-6-1)43-45-44(41-23-13-14-24-42(41)49-43)50-46(53(45)39-19-9-3-10-20-39)37-29-25-33(26-30-37)34-27-31-38(32-28-34)48-52-51-47(36-17-7-2-8-18-36)54(48)40-21-11-4-12-22-40;1-46(2,3)36-28-26-35(27-29-36)45-50-49-44(52-45)34-24-20-31(21-25-34)30-18-22-33(23-19-30)43-48-41-38-16-10-11-17-39(38)47-40(32-12-6-4-7-13-32)42(41)51(43)37-14-8-5-9-15-37/h1-32H;1-33H;1-32H;4-29H,1-3H3 |
| InChIKey | GXGBQECFLXRWOI-UHFFFAOYSA-N |
| XLogP | 46.93 |
| TPSA | 248.96 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 23 |
| Rotatable Bonds | 27 |
| Heavy Atoms | 215 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2763.32 |
| LogP ≤ 5 | 46.93 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 23 |