C280H192N8 — CID 161135007
bis(4-[4-[3-[4-[2,6-bis(4-phenylphenyl)-4-pyridinyl]phenyl]phenyl]phenyl]-2,6-bis(4-phenylphenyl)pyridine);2-[4-[4-[3-[4-[4-(2,6-diphenyl-4-pyridinyl)phenyl]phenyl]phenyl]phenyl]phenyl]-4,6-diphenylpyridine;4-[4-[4-[3-[4-[4-(2,6-diphenyl-4-pyridinyl)phenyl]phenyl]phenyl]phenyl]phenyl]-2,6-diphenylpyridine (PubChem CID 161135007) has the molecular formula C280H192N8 and a molecular weight of 3668.67 g/mol. Its IUPAC name is bis(4-[4-[3-[4-[2,6-bis(4-phenylphenyl)-4-pyridinyl]phenyl]phenyl]phenyl]-2,6-bis(4-phenylphenyl)pyridine);2-[4-[4-[3-[4-[4-(2,6-diphenyl-4-pyridinyl)phenyl]phenyl]phenyl]phenyl]phenyl]-4,6-diphenylpyridine;4-[4-[4-[3-[4-[4-(2,6-diphenyl-4-pyridinyl)phenyl]phenyl]phenyl]phenyl]phenyl]-2,6-diphenylpyridine.
| Compound Name | bis(4-[4-[3-[4-[2,6-bis(4-phenylphenyl)-4-pyridinyl]phenyl]phenyl]phenyl]-2,6-bis(4-phenylphenyl)pyridine);2-[4-[4-[3-[4-[4-(2,6-diphenyl-4-pyridinyl)phenyl]phenyl]phenyl]phenyl]phenyl]-4,6-diphenylpyridine;4-[4-[4-[3-[4-[4-(2,6-diphenyl-4-pyridinyl)phenyl]phenyl]phenyl]phenyl]phenyl]-2,6-diphenylpyridine |
|---|---|
| PubChem CID | 161135007 |
| Molecular Formula | C280H192N8 |
| Molecular Weight | 3668.67 g/mol |
| Exact Mass | 3665.53 |
| IUPAC Name | bis(4-[4-[3-[4-[2,6-bis(4-phenylphenyl)-4-pyridinyl]phenyl]phenyl]phenyl]-2,6-bis(4-phenylphenyl)pyridine);2-[4-[4-[3-[4-[4-(2,6-diphenyl-4-pyridinyl)phenyl]phenyl]phenyl]phenyl]phenyl]-4,6-diphenylpyridine;4-[4-[4-[3-[4-[4-(2,6-diphenyl-4-pyridinyl)phenyl]phenyl]phenyl]phenyl]phenyl]-2,6-diphenylpyridine |
| SMILES | c1ccc(-c2cc(-c3ccc(-c4ccc(-c5cccc(-c6ccc(-c7ccc(-c8cc(-c9ccccc9)nc(-c9ccccc9)c8)cc7)cc6)c5)cc4)cc3)cc(-c3ccccc3)n2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-c3ccc(-c4ccc(-c5cccc(-c6ccc(-c7ccc(-c8cc(-c9ccccc9)nc(-c9ccccc9)c8)cc7)cc6)c5)cc4)cc3)c2)cc1.c1ccc(-c2ccc(-c3cc(-c4ccc(-c5cccc(-c6ccc(-c7cc(-c8ccc(-c9ccccc9)cc8)nc(-c8ccc(-c9ccccc9)cc8)c7)cc6)c5)cc4)cc(-c4ccc(-c5ccccc5)cc4)n3)cc2)cc1.c1ccc(-c2ccc(-c3cc(-c4ccc(-c5cccc(-c6ccc(-c7cc(-c8ccc(-c9ccccc9)cc8)nc(-c8ccc(-c9ccccc9)cc8)c7)cc6)c5)cc4)cc(-c4ccc(-c5ccccc5)cc4)n3)cc2)cc1 |
| InChI | InChI=1S/2C76H52N2.2C64H44N2/c2*1-5-14-53(15-6-1)57-32-40-65(41-33-57)73-49-71(50-74(77-73)66-42-34-58(35-43-66)54-16-7-2-8-17-54)63-28-24-61(25-29-63)69-22-13-23-70(48-69)62-26-30-64(31-27-62)72-51-75(67-44-36-59(37-45-67)55-18-9-3-10-19-55)78-76(52-72)68-46-38-60(39-47-68)56-20-11-4-12-21-56;1-5-14-53(15-6-1)61-41-59(42-62(65-61)54-16-7-2-8-17-54)51-36-28-47(29-37-51)45-24-32-49(33-25-45)57-22-13-23-58(40-57)50-34-26-46(27-35-50)48-30-38-52(39-31-48)60-43-63(55-18-9-3-10-19-55)66-64(44-60)56-20-11-4-12-21-56;1-5-14-45(15-6-1)59-41-61(53-16-7-2-8-17-53)66-64(42-59)56-38-36-49(37-39-56)47-26-32-51(33-27-47)58-23-13-22-57(40-58)50-30-24-46(25-31-50)48-28-34-52(35-29-48)60-43-62(54-18-9-3-10-19-54)65-63(44-60)55-20-11-4-12-21-55/h2*1-52H;2*1-44H |
| InChIKey | UMRHSSOMAAORLH-UHFFFAOYSA-N |
| XLogP | 75.25 |
| TPSA | 103.12 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 8 |
| Rotatable Bonds | 44 |
| Heavy Atoms | 288 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 3668.67 |
| LogP ≤ 5 | 75.25 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 8 |