bis(2-methylphenyl)-diphenylsilane;2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline;5-[1,1-dimethyl-3,4-diphenyl-5-(6-pyridin-2-yl-3-pyridinyl)silol-2-yl]-2-pyridin-2-ylpyridine;2-(4-methylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;2-(6-pyridin-2-yl-3-pyridinyl)-5-[3-[5-(6-pyridin-2-yl-3-pyridinyl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole

C141H108N16O3Si2 — CID 159879631

About bis(2-methylphenyl)-diphenylsilane;2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline;5-[1,1-dimethyl-3,4-diphenyl-5-(6-pyridin-2-yl-3-pyridinyl)silol-2-yl]-2-pyridin-2-ylpyridine;2-(4-methylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;2-(6-pyridin-2-yl-3-pyridinyl)-5-[3-[5-(6-pyridin-2-yl-3-pyridinyl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole

bis(2-methylphenyl)-diphenylsilane;2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline;5-[1,1-dimethyl-3,4-diphenyl-5-(6-pyridin-2-yl-3-pyridinyl)silol-2-yl]-2-pyridin-2-ylpyridine;2-(4-methylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;2-(6-pyridin-2-yl-3-pyridinyl)-5-[3-[5-(6-pyridin-2-yl-3-pyridinyl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole (PubChem CID 159879631) has the molecular formula C141H108N16O3Si2 and a molecular weight of 2130.70 g/mol. Its IUPAC name is bis(2-methylphenyl)-diphenylsilane;2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline;5-[1,1-dimethyl-3,4-diphenyl-5-(6-pyridin-2-yl-3-pyridinyl)silol-2-yl]-2-pyridin-2-ylpyridine;2-(4-methylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;2-(6-pyridin-2-yl-3-pyridinyl)-5-[3-[5-(6-pyridin-2-yl-3-pyridinyl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole.

Molecular Properties

• Compound Name: bis(2-methylphenyl)-diphenylsilane;2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline;5-[1,1-dimethyl-3,4-diphenyl-5-(6-pyridin-2-yl-3-pyridinyl)silol-2-yl]-2-pyridin-2-ylpyridine;2-(4-methylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;2-(6-pyridin-2-yl-3-pyridinyl)-5-[3-[5-(6-pyridin-2-yl-3-pyridinyl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole
• PubChem CID: 159879631
• Molecular Formula: C141H108N16O3Si2
• Molecular Weight: 2130.70 g/mol
• Exact Mass: 2128.83
• IUPAC Name: bis(2-methylphenyl)-diphenylsilane;2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline;5-[1,1-dimethyl-3,4-diphenyl-5-(6-pyridin-2-yl-3-pyridinyl)silol-2-yl]-2-pyridin-2-ylpyridine;2-(4-methylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;2-(6-pyridin-2-yl-3-pyridinyl)-5-[3-[5-(6-pyridin-2-yl-3-pyridinyl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole
• SMILES: C[Si]1(C)C(c2ccc(-c3ccccn3)nc2)=C(c2ccccc2)C(c2ccccc2)=C1c1ccc(-c2ccccn2)nc1.Cc1cc(-c2ccccc2)c2ccc3c(-c4ccccc4)cc(C)nc3c2n1.Cc1ccc(-c2nnc(-c3ccc(-c4ccccc4)cc3)o2)cc1.Cc1ccccc1[Si](c1ccccc1)(c1ccccc1)c1ccccc1C.c1ccc(-c2ccc(-c3nnc(-c4cccc(-c5nnc(-c6ccc(-c7ccccn7)nc6)o5)c4)o3)cn2)nc1
• InChI: InChI=1S/C38H30N4Si.C30H18N8O2.C26H20N2.C26H24Si.C21H16N2O/c1-43(2)37(29-19-21-33(41-25-29)31-17-9-11-23-39-31)35(27-13-5-3-6-14-27)36(28-15-7-4-8-16-28)38(43)30-20-22-34(42-26-30)32-18-10-12-24-40-32;1-3-14-31-23(8-1)25-12-10-21(17-33-25)29-37-35-27(39-29)19-6-5-7-20(16-19)28-36-38-30(40-28)22-11-13-26(34-18-22)24-9-2-4-15-32-24;1-17-15-23(19-9-5-3-6-10-19)21-13-14-22-24(20-11-7-4-8-12-20)16-18(2)28-26(22)25(21)27-17;1-21-13-9-11-19-25(21)27(23-15-5-3-6-16-23,24-17-7-4-8-18-24)26-20-12-10-14-22(26)2;1-15-7-9-18(10-8-15)20-22-23-21(24-20)19-13-11-17(12-14-19)16-5-3-2-4-6-16/h3-26H,1-2H3;1-18H;3-16H,1-2H3;3-20H,1-2H3;2-14H,1H3
• InChIKey: NTJCUPRCXFRKEV-UHFFFAOYSA-N
• XLogP: 30.75
• TPSA: 245.66 Ų
• H-Bond Acceptors: 19
• Rotatable Bonds: 21
• Heavy Atoms: 162
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2130.70
LogP ≤ 5	30.75
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	19

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of bis(2-methylphenyl)-diphenylsilane;2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline;5-[1,1-dimethyl-3,4-diphenyl-5-(6-pyridin-2-yl-3-pyridinyl)silol-2-yl]-2-pyridin-2-ylpyridine;2-(4-methylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;2-(6-pyridin-2-yl-3-pyridinyl)-5-[3-[5-(6-pyridin-2-yl-3-pyridinyl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole?

The IUPAC name of bis(2-methylphenyl)-diphenylsilane;2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline;5-[1,1-dimethyl-3,4-diphenyl-5-(6-pyridin-2-yl-3-pyridinyl)silol-2-yl]-2-pyridin-2-ylpyridine;2-(4-methylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;2-(6-pyridin-2-yl-3-pyridinyl)-5-[3-[5-(6-pyridin-2-yl-3-pyridinyl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole (CID 159879631) is bis(2-methylphenyl)-diphenylsilane;2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline;5-[1,1-dimethyl-3,4-diphenyl-5-(6-pyridin-2-yl-3-pyridinyl)silol-2-yl]-2-pyridin-2-ylpyridine;2-(4-methylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;2-(6-pyridin-2-yl-3-pyridinyl)-5-[3-[5-(6-pyridin-2-yl-3-pyridinyl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole.

What is the SMILES notation for bis(2-methylphenyl)-diphenylsilane;2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline;5-[1,1-dimethyl-3,4-diphenyl-5-(6-pyridin-2-yl-3-pyridinyl)silol-2-yl]-2-pyridin-2-ylpyridine;2-(4-methylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;2-(6-pyridin-2-yl-3-pyridinyl)-5-[3-[5-(6-pyridin-2-yl-3-pyridinyl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole?

The canonical SMILES for bis(2-methylphenyl)-diphenylsilane;2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline;5-[1,1-dimethyl-3,4-diphenyl-5-(6-pyridin-2-yl-3-pyridinyl)silol-2-yl]-2-pyridin-2-ylpyridine;2-(4-methylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;2-(6-pyridin-2-yl-3-pyridinyl)-5-[3-[5-(6-pyridin-2-yl-3-pyridinyl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole is C[Si]1(C)C(c2ccc(-c3ccccn3)nc2)=C(c2ccccc2)C(c2ccccc2)=C1c1ccc(-c2ccccn2)nc1.Cc1cc(-c2ccccc2)c2ccc3c(-c4ccccc4)cc(C)nc3c2n1.Cc1ccc(-c2nnc(-c3ccc(-c4ccccc4)cc3)o2)cc1.Cc1ccccc1[Si](c1ccccc1)(c1ccccc1)c1ccccc1C.c1ccc(-c2ccc(-c3nnc(-c4cccc(-c5nnc(-c6ccc(-c7ccccn7)nc6)o5)c4)o3)cn2)nc1.

What is the InChIKey of bis(2-methylphenyl)-diphenylsilane;2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline;5-[1,1-dimethyl-3,4-diphenyl-5-(6-pyridin-2-yl-3-pyridinyl)silol-2-yl]-2-pyridin-2-ylpyridine;2-(4-methylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;2-(6-pyridin-2-yl-3-pyridinyl)-5-[3-[5-(6-pyridin-2-yl-3-pyridinyl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole?

The InChIKey is NTJCUPRCXFRKEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H30N4Si.C30H18N8O2.C26H20N2.C26H24Si.C21H16N2O/c1-43(2)37(29-19-21-33(41-25-29)31-17-9-11-23-39-31)35(27-13-5-3-6-14-27)36(28-15-7-4-8-16-28)38(43)30-20-22-34(42-26-30)32-18-10-12-24-40-32;1-3-14-31-23(8-1)25-12-10-21(17-33-25)29-37-35-27(39-29)19-6-5-7-20(16-19)28-36-38-30(40-28)22-11-13-26(34-18-22)24-9-2-4-15-32-24;1-17-15-23(19-9-5-3-6-10-19)21-13-14-22-24(20-11-7-4-8-12-20)16-18(2)28-26(22)25(21)27-17;1-21-13-9-11-19-25(21)27(23-15-5-3-6-16-23,24-17-7-4-8-18-24)26-20-12-10-14-22(26)2;1-15-7-9-18(10-8-15)20-22-23-21(24-20)19-13-11-17(12-14-19)16-5-3-2-4-6-16/h3-26H,1-2H3;1-18H;3-16H,1-2H3;3-20H,1-2H3;2-14H,1H3.

What are the key properties of bis(2-methylphenyl)-diphenylsilane;2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline;5-[1,1-dimethyl-3,4-diphenyl-5-(6-pyridin-2-yl-3-pyridinyl)silol-2-yl]-2-pyridin-2-ylpyridine;2-(4-methylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;2-(6-pyridin-2-yl-3-pyridinyl)-5-[3-[5-(6-pyridin-2-yl-3-pyridinyl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole?

bis(2-methylphenyl)-diphenylsilane;2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline;5-[1,1-dimethyl-3,4-diphenyl-5-(6-pyridin-2-yl-3-pyridinyl)silol-2-yl]-2-pyridin-2-ylpyridine;2-(4-methylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;2-(6-pyridin-2-yl-3-pyridinyl)-5-[3-[5-(6-pyridin-2-yl-3-pyridinyl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole has a molecular weight of 2130.70 g/mol, XLogP of 30.75, 21 rotatable bonds, 0 hydrogen bond donors, and 19 hydrogen bond acceptors.

Where does this data come from?

All data for bis(2-methylphenyl)-diphenylsilane;2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline;5-[1,1-dimethyl-3,4-diphenyl-5-(6-pyridin-2-yl-3-pyridinyl)silol-2-yl]-2-pyridin-2-ylpyridine;2-(4-methylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;2-(6-pyridin-2-yl-3-pyridinyl)-5-[3-[5-(6-pyridin-2-yl-3-pyridinyl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole is sourced from PubChem (CID 159879631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).