C170H116N16 — CID 167534445
2,4-diphenyl-6-[4-[4-(4-pyridin-4-ylphenyl)phenyl]phenyl]-1,3,5-triazine;2-phenyl-4-(2-phenylphenyl)-6-[4-[4-(4-pyridin-4-ylphenyl)phenyl]phenyl]-1,3,5-triazine;2-phenyl-4-(3-phenylphenyl)-6-[4-[4-(4-pyridin-4-ylphenyl)phenyl]phenyl]-1,3,5-triazine;2-phenyl-4-(4-phenylphenyl)-6-[4-[4-(4-pyridin-4-ylphenyl)phenyl]phenyl]-1,3,5-triazine (PubChem CID 167534445) has the molecular formula C170H116N16 and a molecular weight of 2382.91 g/mol. Its IUPAC name is 2,4-diphenyl-6-[4-[4-(4-pyridin-4-ylphenyl)phenyl]phenyl]-1,3,5-triazine;2-phenyl-4-(2-phenylphenyl)-6-[4-[4-(4-pyridin-4-ylphenyl)phenyl]phenyl]-1,3,5-triazine;2-phenyl-4-(3-phenylphenyl)-6-[4-[4-(4-pyridin-4-ylphenyl)phenyl]phenyl]-1,3,5-triazine;2-phenyl-4-(4-phenylphenyl)-6-[4-[4-(4-pyridin-4-ylphenyl)phenyl]phenyl]-1,3,5-triazine.
| Compound Name | 2,4-diphenyl-6-[4-[4-(4-pyridin-4-ylphenyl)phenyl]phenyl]-1,3,5-triazine;2-phenyl-4-(2-phenylphenyl)-6-[4-[4-(4-pyridin-4-ylphenyl)phenyl]phenyl]-1,3,5-triazine;2-phenyl-4-(3-phenylphenyl)-6-[4-[4-(4-pyridin-4-ylphenyl)phenyl]phenyl]-1,3,5-triazine;2-phenyl-4-(4-phenylphenyl)-6-[4-[4-(4-pyridin-4-ylphenyl)phenyl]phenyl]-1,3,5-triazine |
|---|---|
| PubChem CID | 167534445 |
| Molecular Formula | C170H116N16 |
| Molecular Weight | 2382.91 g/mol |
| Exact Mass | 2380.96 |
| IUPAC Name | 2,4-diphenyl-6-[4-[4-(4-pyridin-4-ylphenyl)phenyl]phenyl]-1,3,5-triazine;2-phenyl-4-(2-phenylphenyl)-6-[4-[4-(4-pyridin-4-ylphenyl)phenyl]phenyl]-1,3,5-triazine;2-phenyl-4-(3-phenylphenyl)-6-[4-[4-(4-pyridin-4-ylphenyl)phenyl]phenyl]-1,3,5-triazine;2-phenyl-4-(4-phenylphenyl)-6-[4-[4-(4-pyridin-4-ylphenyl)phenyl]phenyl]-1,3,5-triazine |
| SMILES | c1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4ccc(-c5ccc(-c6ccc(-c7ccncc7)cc6)cc5)cc4)n3)cc2)cc1.c1ccc(-c2cccc(-c3nc(-c4ccccc4)nc(-c4ccc(-c5ccc(-c6ccc(-c7ccncc7)cc6)cc5)cc4)n3)c2)cc1.c1ccc(-c2nc(-c3ccc(-c4ccc(-c5ccc(-c6ccncc6)cc5)cc4)cc3)nc(-c3ccccc3-c3ccccc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4ccc(-c5ccc(-c6ccncc6)cc5)cc4)cc3)n2)cc1 |
| InChI | InChI=1S/3C44H30N4.C38H26N4/c1-3-9-37(10-4-1)40-13-7-8-14-41(40)44-47-42(38-11-5-2-6-12-38)46-43(48-44)39-25-23-34(24-26-39)33-17-15-31(16-18-33)32-19-21-35(22-20-32)36-27-29-45-30-28-36;1-3-8-31(9-4-1)40-12-7-13-41(30-40)44-47-42(38-10-5-2-6-11-38)46-43(48-44)39-24-22-35(23-25-39)34-16-14-32(15-17-34)33-18-20-36(21-19-33)37-26-28-45-29-27-37;1-3-7-31(8-4-1)32-19-23-40(24-20-32)43-46-42(39-9-5-2-6-10-39)47-44(48-43)41-25-21-36(22-26-41)35-13-11-33(12-14-35)34-15-17-37(18-16-34)38-27-29-45-30-28-38;1-3-7-33(8-4-1)36-40-37(34-9-5-2-6-10-34)42-38(41-36)35-21-19-30(20-22-35)29-13-11-27(12-14-29)28-15-17-31(18-16-28)32-23-25-39-26-24-32/h3*1-30H;1-26H |
| InChIKey | AJTVZQJZURLHFA-UHFFFAOYSA-N |
| XLogP | 42.08 |
| TPSA | 206.24 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 16 |
| Rotatable Bonds | 27 |
| Heavy Atoms | 186 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2382.91 |
| LogP ≤ 5 | 42.08 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 16 |