10,10-dimethyl-3-N,7-N-diphenyl-3-N,7-N-bis(3-phenylphenyl)-[1]benzosilolo[3,2-b][1]benzofuran-3,7-diamine;10,10-dimethyl-3-N,7-N-diphenyl-3-N,7-N-bis(4-phenylphenyl)-[1]benzosilolo[3,2-b][1]benzofuran-3,7-diamine

C104H80N4O2Si2 — CID 159093716

About 10,10-dimethyl-3-N,7-N-diphenyl-3-N,7-N-bis(3-phenylphenyl)-[1]benzosilolo[3,2-b][1]benzofuran-3,7-diamine;10,10-dimethyl-3-N,7-N-diphenyl-3-N,7-N-bis(4-phenylphenyl)-[1]benzosilolo[3,2-b][1]benzofuran-3,7-diamine

10,10-dimethyl-3-N,7-N-diphenyl-3-N,7-N-bis(3-phenylphenyl)-[1]benzosilolo[3,2-b][1]benzofuran-3,7-diamine;10,10-dimethyl-3-N,7-N-diphenyl-3-N,7-N-bis(4-phenylphenyl)-[1]benzosilolo[3,2-b][1]benzofuran-3,7-diamine (PubChem CID 159093716) has the molecular formula C104H80N4O2Si2 and a molecular weight of 1473.98 g/mol. Its IUPAC name is 10,10-dimethyl-3-N,7-N-diphenyl-3-N,7-N-bis(3-phenylphenyl)-[1]benzosilolo[3,2-b][1]benzofuran-3,7-diamine;10,10-dimethyl-3-N,7-N-diphenyl-3-N,7-N-bis(4-phenylphenyl)-[1]benzosilolo[3,2-b][1]benzofuran-3,7-diamine.

Molecular Properties

• Compound Name: 10,10-dimethyl-3-N,7-N-diphenyl-3-N,7-N-bis(3-phenylphenyl)-[1]benzosilolo[3,2-b][1]benzofuran-3,7-diamine;10,10-dimethyl-3-N,7-N-diphenyl-3-N,7-N-bis(4-phenylphenyl)-[1]benzosilolo[3,2-b][1]benzofuran-3,7-diamine
• PubChem CID: 159093716
• Molecular Formula: C104H80N4O2Si2
• Molecular Weight: 1473.98 g/mol
• Exact Mass: 1472.58
• IUPAC Name: 10,10-dimethyl-3-N,7-N-diphenyl-3-N,7-N-bis(3-phenylphenyl)-[1]benzosilolo[3,2-b][1]benzofuran-3,7-diamine;10,10-dimethyl-3-N,7-N-diphenyl-3-N,7-N-bis(4-phenylphenyl)-[1]benzosilolo[3,2-b][1]benzofuran-3,7-diamine
• SMILES: C[Si]1(C)c2ccc(N(c3ccccc3)c3ccc(-c4ccccc4)cc3)cc2-c2oc3cc(N(c4ccccc4)c4ccc(-c5ccccc5)cc4)ccc3c21.C[Si]1(C)c2ccc(N(c3ccccc3)c3cccc(-c4ccccc4)c3)cc2-c2oc3cc(N(c4ccccc4)c4cccc(-c5ccccc5)c4)ccc3c21
• InChI: InChI=1S/2C52H40N2OSi/c1-56(2)50-32-30-45(53(41-23-11-5-12-24-41)43-27-15-21-39(33-43)37-17-7-3-8-18-37)35-48(50)51-52(56)47-31-29-46(36-49(47)55-51)54(42-25-13-6-14-26-42)44-28-16-22-40(34-44)38-19-9-4-10-20-38;1-56(2)50-34-32-45(53(41-19-11-5-12-20-41)43-27-23-39(24-28-43)37-15-7-3-8-16-37)35-48(50)51-52(56)47-33-31-46(36-49(47)55-51)54(42-21-13-6-14-22-42)44-29-25-40(26-30-44)38-17-9-4-10-18-38/h2*3-36H,1-2H3
• InChIKey: KCJVZVRAOGQUTB-UHFFFAOYSA-N
• XLogP: 27.02
• TPSA: 39.24 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 16
• Heavy Atoms: 112
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1473.98
LogP ≤ 5	27.02
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 10,10-dimethyl-3-N,7-N-diphenyl-3-N,7-N-bis(3-phenylphenyl)-[1]benzosilolo[3,2-b][1]benzofuran-3,7-diamine;10,10-dimethyl-3-N,7-N-diphenyl-3-N,7-N-bis(4-phenylphenyl)-[1]benzosilolo[3,2-b][1]benzofuran-3,7-diamine?

The IUPAC name of 10,10-dimethyl-3-N,7-N-diphenyl-3-N,7-N-bis(3-phenylphenyl)-[1]benzosilolo[3,2-b][1]benzofuran-3,7-diamine;10,10-dimethyl-3-N,7-N-diphenyl-3-N,7-N-bis(4-phenylphenyl)-[1]benzosilolo[3,2-b][1]benzofuran-3,7-diamine (CID 159093716) is 10,10-dimethyl-3-N,7-N-diphenyl-3-N,7-N-bis(3-phenylphenyl)-[1]benzosilolo[3,2-b][1]benzofuran-3,7-diamine;10,10-dimethyl-3-N,7-N-diphenyl-3-N,7-N-bis(4-phenylphenyl)-[1]benzosilolo[3,2-b][1]benzofuran-3,7-diamine.

What is the SMILES notation for 10,10-dimethyl-3-N,7-N-diphenyl-3-N,7-N-bis(3-phenylphenyl)-[1]benzosilolo[3,2-b][1]benzofuran-3,7-diamine;10,10-dimethyl-3-N,7-N-diphenyl-3-N,7-N-bis(4-phenylphenyl)-[1]benzosilolo[3,2-b][1]benzofuran-3,7-diamine?

The canonical SMILES for 10,10-dimethyl-3-N,7-N-diphenyl-3-N,7-N-bis(3-phenylphenyl)-[1]benzosilolo[3,2-b][1]benzofuran-3,7-diamine;10,10-dimethyl-3-N,7-N-diphenyl-3-N,7-N-bis(4-phenylphenyl)-[1]benzosilolo[3,2-b][1]benzofuran-3,7-diamine is C[Si]1(C)c2ccc(N(c3ccccc3)c3ccc(-c4ccccc4)cc3)cc2-c2oc3cc(N(c4ccccc4)c4ccc(-c5ccccc5)cc4)ccc3c21.C[Si]1(C)c2ccc(N(c3ccccc3)c3cccc(-c4ccccc4)c3)cc2-c2oc3cc(N(c4ccccc4)c4cccc(-c5ccccc5)c4)ccc3c21.

What is the InChIKey of 10,10-dimethyl-3-N,7-N-diphenyl-3-N,7-N-bis(3-phenylphenyl)-[1]benzosilolo[3,2-b][1]benzofuran-3,7-diamine;10,10-dimethyl-3-N,7-N-diphenyl-3-N,7-N-bis(4-phenylphenyl)-[1]benzosilolo[3,2-b][1]benzofuran-3,7-diamine?

The InChIKey is KCJVZVRAOGQUTB-UHFFFAOYSA-N. The full InChI is InChI=1S/2C52H40N2OSi/c1-56(2)50-32-30-45(53(41-23-11-5-12-24-41)43-27-15-21-39(33-43)37-17-7-3-8-18-37)35-48(50)51-52(56)47-31-29-46(36-49(47)55-51)54(42-25-13-6-14-26-42)44-28-16-22-40(34-44)38-19-9-4-10-20-38;1-56(2)50-34-32-45(53(41-19-11-5-12-20-41)43-27-23-39(24-28-43)37-15-7-3-8-16-37)35-48(50)51-52(56)47-33-31-46(36-49(47)55-51)54(42-21-13-6-14-22-42)44-29-25-40(26-30-44)38-17-9-4-10-18-38/h2*3-36H,1-2H3.

What are the key properties of 10,10-dimethyl-3-N,7-N-diphenyl-3-N,7-N-bis(3-phenylphenyl)-[1]benzosilolo[3,2-b][1]benzofuran-3,7-diamine;10,10-dimethyl-3-N,7-N-diphenyl-3-N,7-N-bis(4-phenylphenyl)-[1]benzosilolo[3,2-b][1]benzofuran-3,7-diamine?

10,10-dimethyl-3-N,7-N-diphenyl-3-N,7-N-bis(3-phenylphenyl)-[1]benzosilolo[3,2-b][1]benzofuran-3,7-diamine;10,10-dimethyl-3-N,7-N-diphenyl-3-N,7-N-bis(4-phenylphenyl)-[1]benzosilolo[3,2-b][1]benzofuran-3,7-diamine has a molecular weight of 1473.98 g/mol, XLogP of 27.02, 16 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 10,10-dimethyl-3-N,7-N-diphenyl-3-N,7-N-bis(3-phenylphenyl)-[1]benzosilolo[3,2-b][1]benzofuran-3,7-diamine;10,10-dimethyl-3-N,7-N-diphenyl-3-N,7-N-bis(4-phenylphenyl)-[1]benzosilolo[3,2-b][1]benzofuran-3,7-diamine is sourced from PubChem (CID 159093716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).