bis([1,3]oxazolo[3,2-a]benzimidazol-7-yl)-diphenylsilane;bis(bis[3-([1,3]oxazolo[3,2-a]benzimidazol-7-yl)phenyl]-diphenylsilane);diphenyl-bis[3-([1,3]thiazolo[3,2-a]benzimidazol-7-yl)phenyl]silane;diphenyl-bis([1,3]thiazolo[3,2-a]benzimidazol-7-yl)silane

C186H124N20O6S4Si5 — CID 158997601

About bis([1,3]oxazolo[3,2-a]benzimidazol-7-yl)-diphenylsilane;bis(bis[3-([1,3]oxazolo[3,2-a]benzimidazol-7-yl)phenyl]-diphenylsilane);diphenyl-bis[3-([1,3]thiazolo[3,2-a]benzimidazol-7-yl)phenyl]silane;diphenyl-bis([1,3]thiazolo[3,2-a]benzimidazol-7-yl)silane

bis([1,3]oxazolo[3,2-a]benzimidazol-7-yl)-diphenylsilane;bis(bis[3-([1,3]oxazolo[3,2-a]benzimidazol-7-yl)phenyl]-diphenylsilane);diphenyl-bis[3-([1,3]thiazolo[3,2-a]benzimidazol-7-yl)phenyl]silane;diphenyl-bis([1,3]thiazolo[3,2-a]benzimidazol-7-yl)silane (PubChem CID 158997601) has the molecular formula C186H124N20O6S4Si5 and a molecular weight of 3003.87 g/mol. Its IUPAC name is bis([1,3]oxazolo[3,2-a]benzimidazol-7-yl)-diphenylsilane;bis(bis[3-([1,3]oxazolo[3,2-a]benzimidazol-7-yl)phenyl]-diphenylsilane);diphenyl-bis[3-([1,3]thiazolo[3,2-a]benzimidazol-7-yl)phenyl]silane;diphenyl-bis([1,3]thiazolo[3,2-a]benzimidazol-7-yl)silane.

Molecular Properties

• Compound Name: bis([1,3]oxazolo[3,2-a]benzimidazol-7-yl)-diphenylsilane;bis(bis[3-([1,3]oxazolo[3,2-a]benzimidazol-7-yl)phenyl]-diphenylsilane);diphenyl-bis[3-([1,3]thiazolo[3,2-a]benzimidazol-7-yl)phenyl]silane;diphenyl-bis([1,3]thiazolo[3,2-a]benzimidazol-7-yl)silane
• PubChem CID: 158997601
• Molecular Formula: C186H124N20O6S4Si5
• Molecular Weight: 3003.87 g/mol
• Exact Mass: 3000.77
• IUPAC Name: bis([1,3]oxazolo[3,2-a]benzimidazol-7-yl)-diphenylsilane;bis(bis[3-([1,3]oxazolo[3,2-a]benzimidazol-7-yl)phenyl]-diphenylsilane);diphenyl-bis[3-([1,3]thiazolo[3,2-a]benzimidazol-7-yl)phenyl]silane;diphenyl-bis([1,3]thiazolo[3,2-a]benzimidazol-7-yl)silane
• SMILES: c1ccc([Si](c2ccccc2)(c2ccc3nc4occn4c3c2)c2ccc3nc4occn4c3c2)cc1.c1ccc([Si](c2ccccc2)(c2ccc3nc4sccn4c3c2)c2ccc3nc4sccn4c3c2)cc1.c1ccc([Si](c2ccccc2)(c2cccc(-c3ccc4nc5occn5c4c3)c2)c2cccc(-c3ccc4nc5occn5c4c3)c2)cc1.c1ccc([Si](c2ccccc2)(c2cccc(-c3ccc4nc5occn5c4c3)c2)c2cccc(-c3ccc4nc5occn5c4c3)c2)cc1.c1ccc([Si](c2ccccc2)(c2cccc(-c3ccc4nc5sccn5c4c3)c2)c2cccc(-c3ccc4nc5sccn5c4c3)c2)cc1
• InChI: InChI=1S/2C42H28N4O2Si.C42H28N4S2Si.C30H20N4O2Si.C30H20N4S2Si/c3*1-3-11-33(12-4-1)49(34-13-5-2-6-14-34,35-15-7-9-29(25-35)31-17-19-37-39(27-31)45-21-23-47-41(45)43-37)36-16-8-10-30(26-36)32-18-20-38-40(28-32)46-22-24-48-42(46)44-38;2*1-3-7-21(8-4-1)37(22-9-5-2-6-10-22,23-11-13-25-27(19-23)33-15-17-35-29(33)31-25)24-12-14-26-28(20-24)34-16-18-36-30(34)32-26/h3*1-28H;2*1-20H
• InChIKey: JQXWYNCQCNCVEQ-UHFFFAOYSA-N
• XLogP: 31.14
• TPSA: 251.84 Ų
• H-Bond Acceptors: 30
• Rotatable Bonds: 26
• Heavy Atoms: 221
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3003.87
LogP ≤ 5	31.14
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	30

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of bis([1,3]oxazolo[3,2-a]benzimidazol-7-yl)-diphenylsilane;bis(bis[3-([1,3]oxazolo[3,2-a]benzimidazol-7-yl)phenyl]-diphenylsilane);diphenyl-bis[3-([1,3]thiazolo[3,2-a]benzimidazol-7-yl)phenyl]silane;diphenyl-bis([1,3]thiazolo[3,2-a]benzimidazol-7-yl)silane?

The IUPAC name of bis([1,3]oxazolo[3,2-a]benzimidazol-7-yl)-diphenylsilane;bis(bis[3-([1,3]oxazolo[3,2-a]benzimidazol-7-yl)phenyl]-diphenylsilane);diphenyl-bis[3-([1,3]thiazolo[3,2-a]benzimidazol-7-yl)phenyl]silane;diphenyl-bis([1,3]thiazolo[3,2-a]benzimidazol-7-yl)silane (CID 158997601) is bis([1,3]oxazolo[3,2-a]benzimidazol-7-yl)-diphenylsilane;bis(bis[3-([1,3]oxazolo[3,2-a]benzimidazol-7-yl)phenyl]-diphenylsilane);diphenyl-bis[3-([1,3]thiazolo[3,2-a]benzimidazol-7-yl)phenyl]silane;diphenyl-bis([1,3]thiazolo[3,2-a]benzimidazol-7-yl)silane.

What is the SMILES notation for bis([1,3]oxazolo[3,2-a]benzimidazol-7-yl)-diphenylsilane;bis(bis[3-([1,3]oxazolo[3,2-a]benzimidazol-7-yl)phenyl]-diphenylsilane);diphenyl-bis[3-([1,3]thiazolo[3,2-a]benzimidazol-7-yl)phenyl]silane;diphenyl-bis([1,3]thiazolo[3,2-a]benzimidazol-7-yl)silane?

The canonical SMILES for bis([1,3]oxazolo[3,2-a]benzimidazol-7-yl)-diphenylsilane;bis(bis[3-([1,3]oxazolo[3,2-a]benzimidazol-7-yl)phenyl]-diphenylsilane);diphenyl-bis[3-([1,3]thiazolo[3,2-a]benzimidazol-7-yl)phenyl]silane;diphenyl-bis([1,3]thiazolo[3,2-a]benzimidazol-7-yl)silane is c1ccc([Si](c2ccccc2)(c2ccc3nc4occn4c3c2)c2ccc3nc4occn4c3c2)cc1.c1ccc([Si](c2ccccc2)(c2ccc3nc4sccn4c3c2)c2ccc3nc4sccn4c3c2)cc1.c1ccc([Si](c2ccccc2)(c2cccc(-c3ccc4nc5occn5c4c3)c2)c2cccc(-c3ccc4nc5occn5c4c3)c2)cc1.c1ccc([Si](c2ccccc2)(c2cccc(-c3ccc4nc5occn5c4c3)c2)c2cccc(-c3ccc4nc5occn5c4c3)c2)cc1.c1ccc([Si](c2ccccc2)(c2cccc(-c3ccc4nc5sccn5c4c3)c2)c2cccc(-c3ccc4nc5sccn5c4c3)c2)cc1.

What is the InChIKey of bis([1,3]oxazolo[3,2-a]benzimidazol-7-yl)-diphenylsilane;bis(bis[3-([1,3]oxazolo[3,2-a]benzimidazol-7-yl)phenyl]-diphenylsilane);diphenyl-bis[3-([1,3]thiazolo[3,2-a]benzimidazol-7-yl)phenyl]silane;diphenyl-bis([1,3]thiazolo[3,2-a]benzimidazol-7-yl)silane?

The InChIKey is JQXWYNCQCNCVEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C42H28N4O2Si.C42H28N4S2Si.C30H20N4O2Si.C30H20N4S2Si/c3*1-3-11-33(12-4-1)49(34-13-5-2-6-14-34,35-15-7-9-29(25-35)31-17-19-37-39(27-31)45-21-23-47-41(45)43-37)36-16-8-10-30(26-36)32-18-20-38-40(28-32)46-22-24-48-42(46)44-38;2*1-3-7-21(8-4-1)37(22-9-5-2-6-10-22,23-11-13-25-27(19-23)33-15-17-35-29(33)31-25)24-12-14-26-28(20-24)34-16-18-36-30(34)32-26/h3*1-28H;2*1-20H.

What are the key properties of bis([1,3]oxazolo[3,2-a]benzimidazol-7-yl)-diphenylsilane;bis(bis[3-([1,3]oxazolo[3,2-a]benzimidazol-7-yl)phenyl]-diphenylsilane);diphenyl-bis[3-([1,3]thiazolo[3,2-a]benzimidazol-7-yl)phenyl]silane;diphenyl-bis([1,3]thiazolo[3,2-a]benzimidazol-7-yl)silane?

bis([1,3]oxazolo[3,2-a]benzimidazol-7-yl)-diphenylsilane;bis(bis[3-([1,3]oxazolo[3,2-a]benzimidazol-7-yl)phenyl]-diphenylsilane);diphenyl-bis[3-([1,3]thiazolo[3,2-a]benzimidazol-7-yl)phenyl]silane;diphenyl-bis([1,3]thiazolo[3,2-a]benzimidazol-7-yl)silane has a molecular weight of 3003.87 g/mol, XLogP of 31.14, 26 rotatable bonds, 0 hydrogen bond donors, and 30 hydrogen bond acceptors.

Where does this data come from?

All data for bis([1,3]oxazolo[3,2-a]benzimidazol-7-yl)-diphenylsilane;bis(bis[3-([1,3]oxazolo[3,2-a]benzimidazol-7-yl)phenyl]-diphenylsilane);diphenyl-bis[3-([1,3]thiazolo[3,2-a]benzimidazol-7-yl)phenyl]silane;diphenyl-bis([1,3]thiazolo[3,2-a]benzimidazol-7-yl)silane is sourced from PubChem (CID 158997601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).