C446H302N26 — CID 161207659
2,4-bis[3-[3-(4-naphthalen-1-ylphenyl)phenyl]phenyl]-6-phenyl-1,3,5-triazine;2-phenyl-4,6-bis[2-[3-(2-phenylphenyl)phenyl]phenyl]-1,3,5-triazine;2-phenyl-4,6-bis[2-[3-(3-phenylphenyl)phenyl]phenyl]-1,3,5-triazine;2-phenyl-4,6-bis[2-[3-(4-phenylphenyl)phenyl]phenyl]-1,3,5-triazine;2-phenyl-4,6-bis[2-[4-(3-phenylphenyl)phenyl]phenyl]-1,3,5-triazine;2-phenyl-4,6-bis[2-(3-phenylphenyl)phenyl]-1,3,5-triazine;2-phenyl-4,6-bis[2-(4-phenylphenyl)phenyl]-1,3,5-triazine;5-[4-[3-[3-[4-phenyl-6-[3-[3-(4-quinolin-5-ylphenyl)phenyl]phenyl]-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]quinoline (PubChem CID 161207659) has the molecular formula C446H302N26 and a molecular weight of 6025.50 g/mol. Its IUPAC name is 2,4-bis[3-[3-(4-naphthalen-1-ylphenyl)phenyl]phenyl]-6-phenyl-1,3,5-triazine;2-phenyl-4,6-bis[2-[3-(2-phenylphenyl)phenyl]phenyl]-1,3,5-triazine;2-phenyl-4,6-bis[2-[3-(3-phenylphenyl)phenyl]phenyl]-1,3,5-triazine;2-phenyl-4,6-bis[2-[3-(4-phenylphenyl)phenyl]phenyl]-1,3,5-triazine;2-phenyl-4,6-bis[2-[4-(3-phenylphenyl)phenyl]phenyl]-1,3,5-triazine;2-phenyl-4,6-bis[2-(3-phenylphenyl)phenyl]-1,3,5-triazine;2-phenyl-4,6-bis[2-(4-phenylphenyl)phenyl]-1,3,5-triazine;5-[4-[3-[3-[4-phenyl-6-[3-[3-(4-quinolin-5-ylphenyl)phenyl]phenyl]-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]quinoline.
| Compound Name | 2,4-bis[3-[3-(4-naphthalen-1-ylphenyl)phenyl]phenyl]-6-phenyl-1,3,5-triazine;2-phenyl-4,6-bis[2-[3-(2-phenylphenyl)phenyl]phenyl]-1,3,5-triazine;2-phenyl-4,6-bis[2-[3-(3-phenylphenyl)phenyl]phenyl]-1,3,5-triazine;2-phenyl-4,6-bis[2-[3-(4-phenylphenyl)phenyl]phenyl]-1,3,5-triazine;2-phenyl-4,6-bis[2-[4-(3-phenylphenyl)phenyl]phenyl]-1,3,5-triazine;2-phenyl-4,6-bis[2-(3-phenylphenyl)phenyl]-1,3,5-triazine;2-phenyl-4,6-bis[2-(4-phenylphenyl)phenyl]-1,3,5-triazine;5-[4-[3-[3-[4-phenyl-6-[3-[3-(4-quinolin-5-ylphenyl)phenyl]phenyl]-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]quinoline |
|---|---|
| PubChem CID | 161207659 |
| Molecular Formula | C446H302N26 |
| Molecular Weight | 6025.50 g/mol |
| Exact Mass | 6020.44 |
| IUPAC Name | 2,4-bis[3-[3-(4-naphthalen-1-ylphenyl)phenyl]phenyl]-6-phenyl-1,3,5-triazine;2-phenyl-4,6-bis[2-[3-(2-phenylphenyl)phenyl]phenyl]-1,3,5-triazine;2-phenyl-4,6-bis[2-[3-(3-phenylphenyl)phenyl]phenyl]-1,3,5-triazine;2-phenyl-4,6-bis[2-[3-(4-phenylphenyl)phenyl]phenyl]-1,3,5-triazine;2-phenyl-4,6-bis[2-[4-(3-phenylphenyl)phenyl]phenyl]-1,3,5-triazine;2-phenyl-4,6-bis[2-(3-phenylphenyl)phenyl]-1,3,5-triazine;2-phenyl-4,6-bis[2-(4-phenylphenyl)phenyl]-1,3,5-triazine;5-[4-[3-[3-[4-phenyl-6-[3-[3-(4-quinolin-5-ylphenyl)phenyl]phenyl]-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]quinoline |
| SMILES | c1ccc(-c2ccc(-c3cccc(-c4ccccc4-c4nc(-c5ccccc5)nc(-c5ccccc5-c5cccc(-c6ccc(-c7ccccc7)cc6)c5)n4)c3)cc2)cc1.c1ccc(-c2ccc(-c3ccccc3-c3nc(-c4ccccc4)nc(-c4ccccc4-c4ccc(-c5ccccc5)cc4)n3)cc2)cc1.c1ccc(-c2cccc(-c3ccc(-c4ccccc4-c4nc(-c5ccccc5)nc(-c5ccccc5-c5ccc(-c6cccc(-c7ccccc7)c6)cc5)n4)cc3)c2)cc1.c1ccc(-c2cccc(-c3cccc(-c4ccccc4-c4nc(-c5ccccc5)nc(-c5ccccc5-c5cccc(-c6cccc(-c7ccccc7)c6)c5)n4)c3)c2)cc1.c1ccc(-c2cccc(-c3ccccc3-c3nc(-c4ccccc4)nc(-c4ccccc4-c4cccc(-c5ccccc5)c4)n3)c2)cc1.c1ccc(-c2nc(-c3cccc(-c4cccc(-c5ccc(-c6cccc7ccccc67)cc5)c4)c3)nc(-c3cccc(-c4cccc(-c5ccc(-c6cccc7ccccc67)cc5)c4)c3)n2)cc1.c1ccc(-c2nc(-c3cccc(-c4cccc(-c5ccc(-c6cccc7ncccc67)cc5)c4)c3)nc(-c3cccc(-c4cccc(-c5ccc(-c6cccc7ncccc67)cc5)c4)c3)n2)cc1.c1ccc(-c2nc(-c3ccccc3-c3cccc(-c4ccccc4-c4ccccc4)c3)nc(-c3ccccc3-c3cccc(-c4ccccc4-c4ccccc4)c3)n2)cc1 |
| InChI | InChI=1S/C65H43N3.C63H41N5.4C57H39N3.2C45H31N3/c1-2-16-50(17-3-1)63-66-64(57-26-10-24-55(42-57)53-22-8-20-51(40-53)44-32-36-48(37-33-44)61-30-12-18-46-14-4-6-28-59(46)61)68-65(67-63)58-27-11-25-56(43-58)54-23-9-21-52(41-54)45-34-38-49(39-35-45)62-31-13-19-47-15-5-7-29-60(47)62;1-2-12-46(13-3-1)61-66-62(53-20-6-18-51(40-53)49-16-4-14-47(38-49)42-28-32-44(33-29-42)55-22-8-26-59-57(55)24-10-36-64-59)68-63(67-61)54-21-7-19-52(41-54)50-17-5-15-48(39-50)43-30-34-45(35-31-43)56-23-9-27-60-58(56)25-11-37-65-60;1-4-18-40(19-5-1)43-24-14-26-45(36-43)47-28-16-30-49(38-47)51-32-10-12-34-53(51)56-58-55(42-22-8-3-9-23-42)59-57(60-56)54-35-13-11-33-52(54)50-31-17-29-48(39-50)46-27-15-25-44(37-46)41-20-6-2-7-21-41;1-4-20-40(21-5-1)47-30-10-12-32-49(47)43-26-18-28-45(38-43)51-34-14-16-36-53(51)56-58-55(42-24-8-3-9-25-42)59-57(60-56)54-37-17-15-35-52(54)46-29-19-27-44(39-46)50-33-13-11-31-48(50)41-22-6-2-7-23-41;1-4-16-40(17-5-1)47-22-14-24-49(38-47)42-30-34-44(35-31-42)51-26-10-12-28-53(51)56-58-55(46-20-8-3-9-21-46)59-57(60-56)54-29-13-11-27-52(54)45-36-32-43(33-37-45)50-25-15-23-48(39-50)41-18-6-2-7-19-41;1-4-16-40(17-5-1)42-30-34-44(35-31-42)47-22-14-24-49(38-47)51-26-10-12-28-53(51)56-58-55(46-20-8-3-9-21-46)59-57(60-56)54-29-13-11-27-52(54)50-25-15-23-48(39-50)45-36-32-43(33-37-45)41-18-6-2-7-19-41;1-4-16-32(17-5-1)35-22-14-24-37(30-35)39-26-10-12-28-41(39)44-46-43(34-20-8-3-9-21-34)47-45(48-44)42-29-13-11-27-40(42)38-25-15-23-36(31-38)33-18-6-2-7-19-33;1-4-14-32(15-5-1)34-24-28-36(29-25-34)39-20-10-12-22-41(39)44-46-43(38-18-8-3-9-19-38)47-45(48-44)42-23-13-11-21-40(42)37-30-26-35(27-31-37)33-16-6-2-7-17-33/h1-43H;1-41H;4*1-39H;2*1-31H |
| InChIKey | UVUZNAQYORCSFJ-UHFFFAOYSA-N |
| XLogP | 115.73 |
| TPSA | 335.14 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 26 |
| Rotatable Bonds | 68 |
| Heavy Atoms | 472 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 6025.50 |
| LogP ≤ 5 | 115.73 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 26 |