C253H174N14 — CID 160789301
2-[3-[4-[3,5-bis[2-[3-(4,6-diphenyl-2-pyridinyl)phenyl]-6-methyl-4-pyridinyl]phenyl]-6-methyl-2-pyridinyl]phenyl]-4,6-diphenylpyridine;4-[3-(2,6-diphenyl-4-pyridinyl)phenyl]-2-[3-[4-[3-(2,6-diphenyl-4-pyridinyl)phenyl]-6-phenyl-2-pyridinyl]phenyl]-6-phenylpyridine;2-[4-[4-(2,6-diphenyl-4-pyridinyl)phenyl]phenyl]-4-[3-[2-[4-[4-(2,6-diphenyl-4-pyridinyl)phenyl]phenyl]-6-phenyl-4-pyridinyl]phenyl]-6-phenylpyridine (PubChem CID 160789301) has the molecular formula C253H174N14 and a molecular weight of 3410.27 g/mol. Its IUPAC name is 2-[3-[4-[3,5-bis[2-[3-(4,6-diphenyl-2-pyridinyl)phenyl]-6-methyl-4-pyridinyl]phenyl]-6-methyl-2-pyridinyl]phenyl]-4,6-diphenylpyridine;4-[3-(2,6-diphenyl-4-pyridinyl)phenyl]-2-[3-[4-[3-(2,6-diphenyl-4-pyridinyl)phenyl]-6-phenyl-2-pyridinyl]phenyl]-6-phenylpyridine;2-[4-[4-(2,6-diphenyl-4-pyridinyl)phenyl]phenyl]-4-[3-[2-[4-[4-(2,6-diphenyl-4-pyridinyl)phenyl]phenyl]-6-phenyl-4-pyridinyl]phenyl]-6-phenylpyridine.
| Compound Name | 2-[3-[4-[3,5-bis[2-[3-(4,6-diphenyl-2-pyridinyl)phenyl]-6-methyl-4-pyridinyl]phenyl]-6-methyl-2-pyridinyl]phenyl]-4,6-diphenylpyridine;4-[3-(2,6-diphenyl-4-pyridinyl)phenyl]-2-[3-[4-[3-(2,6-diphenyl-4-pyridinyl)phenyl]-6-phenyl-2-pyridinyl]phenyl]-6-phenylpyridine;2-[4-[4-(2,6-diphenyl-4-pyridinyl)phenyl]phenyl]-4-[3-[2-[4-[4-(2,6-diphenyl-4-pyridinyl)phenyl]phenyl]-6-phenyl-4-pyridinyl]phenyl]-6-phenylpyridine |
|---|---|
| PubChem CID | 160789301 |
| Molecular Formula | C253H174N14 |
| Molecular Weight | 3410.27 g/mol |
| Exact Mass | 3407.40 |
| IUPAC Name | 2-[3-[4-[3,5-bis[2-[3-(4,6-diphenyl-2-pyridinyl)phenyl]-6-methyl-4-pyridinyl]phenyl]-6-methyl-2-pyridinyl]phenyl]-4,6-diphenylpyridine;4-[3-(2,6-diphenyl-4-pyridinyl)phenyl]-2-[3-[4-[3-(2,6-diphenyl-4-pyridinyl)phenyl]-6-phenyl-2-pyridinyl]phenyl]-6-phenylpyridine;2-[4-[4-(2,6-diphenyl-4-pyridinyl)phenyl]phenyl]-4-[3-[2-[4-[4-(2,6-diphenyl-4-pyridinyl)phenyl]phenyl]-6-phenyl-4-pyridinyl]phenyl]-6-phenylpyridine |
| SMILES | Cc1cc(-c2cc(-c3cc(C)nc(-c4cccc(-c5cc(-c6ccccc6)cc(-c6ccccc6)n5)c4)c3)cc(-c3cc(C)nc(-c4cccc(-c5cc(-c6ccccc6)cc(-c6ccccc6)n5)c4)c3)c2)cc(-c2cccc(-c3cc(-c4ccccc4)cc(-c4ccccc4)n3)c2)n1.c1ccc(-c2cc(-c3ccc(-c4ccc(-c5cc(-c6cccc(-c7cc(-c8ccccc8)nc(-c8ccc(-c9ccc(-c%10cc(-c%11ccccc%11)nc(-c%11ccccc%11)c%10)cc9)cc8)c7)c6)cc(-c6ccccc6)n5)cc4)cc3)cc(-c3ccccc3)n2)cc1.c1ccc(-c2cc(-c3cccc(-c4cc(-c5ccccc5)nc(-c5cccc(-c6cc(-c7cccc(-c8cc(-c9ccccc9)nc(-c9ccccc9)c8)c7)cc(-c7ccccc7)n6)c5)c4)c3)cc(-c3ccccc3)n2)cc1 |
| InChI | InChI=1S/C93H66N6.C86H58N4.C74H50N4/c1-61-43-76(52-88(94-61)70-37-22-40-73(46-70)91-58-82(64-25-10-4-11-26-64)55-85(97-91)67-31-16-7-17-32-67)79-49-80(77-44-62(2)95-89(53-77)71-38-23-41-74(47-71)92-59-83(65-27-12-5-13-28-65)56-86(98-92)68-33-18-8-19-34-68)51-81(50-79)78-45-63(3)96-90(54-78)72-39-24-42-75(48-72)93-60-84(66-29-14-6-15-30-66)57-87(99-93)69-35-20-9-21-36-69;1-7-20-65(21-8-1)79-51-75(52-80(87-79)66-22-9-2-10-23-66)63-38-34-59(35-39-63)61-42-46-71(47-43-61)85-57-77(55-83(89-85)69-28-15-5-16-29-69)73-32-19-33-74(50-73)78-56-84(70-30-17-6-18-31-70)90-86(58-78)72-48-44-62(45-49-72)60-36-40-64(41-37-60)76-53-81(67-24-11-3-12-25-67)88-82(54-76)68-26-13-4-14-27-68;1-7-22-51(23-8-1)67-43-63(44-68(75-67)52-24-9-2-10-25-52)57-34-19-36-59(40-57)65-47-71(55-30-15-5-16-31-55)77-73(49-65)61-38-21-39-62(42-61)74-50-66(48-72(78-74)56-32-17-6-18-33-56)60-37-20-35-58(41-60)64-45-69(53-26-11-3-12-27-53)76-70(46-64)54-28-13-4-14-29-54/h4-60H,1-3H3;1-58H;1-50H |
| InChIKey | SBPZWBALIGNSBK-UHFFFAOYSA-N |
| XLogP | 65.86 |
| TPSA | 180.46 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 14 |
| Rotatable Bonds | 41 |
| Heavy Atoms | 267 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 3410.27 |
| LogP ≤ 5 | 65.86 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 14 |