C148H96N32 — CID 157187029
2,4-bis(4,6-diphenyl-1,3,5-triazin-2-yl)-6-phenyl-1,3,5-triazine;2-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenylpyrimidin-4-yl]-4,6-diphenyl-1,3,5-triazine;2-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-pyridinyl]-4,6-diphenyl-1,3,5-triazine;2-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)pyrimidin-4-yl]-4,6-diphenyl-1,3,5-triazine (PubChem CID 157187029) has the molecular formula C148H96N32 and a molecular weight of 2322.62 g/mol. Its IUPAC name is 2,4-bis(4,6-diphenyl-1,3,5-triazin-2-yl)-6-phenyl-1,3,5-triazine;2-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenylpyrimidin-4-yl]-4,6-diphenyl-1,3,5-triazine;2-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-pyridinyl]-4,6-diphenyl-1,3,5-triazine;2-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)pyrimidin-4-yl]-4,6-diphenyl-1,3,5-triazine.
| Compound Name | 2,4-bis(4,6-diphenyl-1,3,5-triazin-2-yl)-6-phenyl-1,3,5-triazine;2-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenylpyrimidin-4-yl]-4,6-diphenyl-1,3,5-triazine;2-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-pyridinyl]-4,6-diphenyl-1,3,5-triazine;2-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)pyrimidin-4-yl]-4,6-diphenyl-1,3,5-triazine |
|---|---|
| PubChem CID | 157187029 |
| Molecular Formula | C148H96N32 |
| Molecular Weight | 2322.62 g/mol |
| Exact Mass | 2320.85 |
| IUPAC Name | 2,4-bis(4,6-diphenyl-1,3,5-triazin-2-yl)-6-phenyl-1,3,5-triazine;2-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenylpyrimidin-4-yl]-4,6-diphenyl-1,3,5-triazine;2-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-pyridinyl]-4,6-diphenyl-1,3,5-triazine;2-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)pyrimidin-4-yl]-4,6-diphenyl-1,3,5-triazine |
| SMILES | c1ccc(-c2nc(-c3ccccc3)nc(-c3ccnc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccnc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)n3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3nc(-c4ccccc4)nc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)n3)n2)cc1.c1ccc(-c2nc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)n2)cc1 |
| InChI | InChI=1S/C40H26N8.C39H25N9.C35H23N7.C34H22N8/c1-6-16-27(17-7-1)34-41-32(39-45-35(28-18-8-2-9-19-28)43-36(46-39)29-20-10-3-11-21-29)26-33(42-34)40-47-37(30-22-12-4-13-23-30)44-38(48-40)31-24-14-5-15-25-31;1-6-16-26(17-7-1)31-40-32(27-18-8-2-9-19-27)43-36(42-31)38-46-35(30-24-14-5-15-25-30)47-39(48-38)37-44-33(28-20-10-3-11-21-28)41-34(45-37)29-22-12-4-13-23-29;1-5-13-24(14-6-1)30-37-31(25-15-7-2-8-16-25)40-34(39-30)28-21-22-36-29(23-28)35-41-32(26-17-9-3-10-18-26)38-33(42-35)27-19-11-4-12-20-27;1-5-13-23(14-6-1)28-37-29(24-15-7-2-8-16-24)40-32(39-28)27-21-22-35-33(36-27)34-41-30(25-17-9-3-10-18-25)38-31(42-34)26-19-11-4-12-20-26/h1-26H;1-25H;1-23H;1-22H |
| InChIKey | APFXXSPSMAMGOI-UHFFFAOYSA-N |
| XLogP | 30.73 |
| TPSA | 412.48 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 32 |
| Rotatable Bonds | 26 |
| Heavy Atoms | 180 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2322.62 |
| LogP ≤ 5 | 30.73 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 32 |