(8-carbazol-9-yldibenzofuran-4-yl)-diphenyl-(8-pyrido[2,3-b]indol-9-yldibenzofuran-4-yl)silane

C59H37N3O2Si — CID 140811582

About (8-carbazol-9-yldibenzofuran-4-yl)-diphenyl-(8-pyrido[2,3-b]indol-9-yldibenzofuran-4-yl)silane

(8-carbazol-9-yldibenzofuran-4-yl)-diphenyl-(8-pyrido[2,3-b]indol-9-yldibenzofuran-4-yl)silane (PubChem CID 140811582) has the molecular formula C59H37N3O2Si and a molecular weight of 848.05 g/mol. Its IUPAC name is (8-carbazol-9-yldibenzofuran-4-yl)-diphenyl-(8-pyrido[2,3-b]indol-9-yldibenzofuran-4-yl)silane.

Molecular Properties

• Compound Name: (8-carbazol-9-yldibenzofuran-4-yl)-diphenyl-(8-pyrido[2,3-b]indol-9-yldibenzofuran-4-yl)silane
• PubChem CID: 140811582
• Molecular Formula: C59H37N3O2Si
• Molecular Weight: 848.05 g/mol
• Exact Mass: 847.27
• IUPAC Name: (8-carbazol-9-yldibenzofuran-4-yl)-diphenyl-(8-pyrido[2,3-b]indol-9-yldibenzofuran-4-yl)silane
• SMILES: c1ccc([Si](c2ccccc2)(c2cccc3c2oc2ccc(-n4c5ccccc5c5ccccc54)cc23)c2cccc3c2oc2ccc(-n4c5ccccc5c5cccnc54)cc23)cc1
• InChI: InChI=1S/C59H37N3O2Si/c1-3-16-40(17-4-1)65(41-18-5-2-6-19-41,55-29-13-23-45-48-36-38(31-33-53(48)63-57(45)55)61-50-26-10-7-20-42(50)43-21-8-11-27-51(43)61)56-30-14-24-46-49-37-39(32-34-54(49)64-58(46)56)62-52-28-12-9-22-44(52)47-25-15-35-60-59(47)62/h1-37H
• InChIKey: NFLZKXLERPDTDR-UHFFFAOYSA-N
• XLogP: 12.45
• TPSA: 49.03 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 6
• Heavy Atoms: 65
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	848.05
LogP ≤ 5	12.45
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	5

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 (8-carbazol-9-yldibenzofuran-4-yl)-diphenyl-(8-pyrido[2,3-b]indol-9-yldibenzofuran-4-yl)silane?

The IUPAC name of (8-carbazol-9-yldibenzofuran-4-yl)-diphenyl-(8-pyrido[2,3-b]indol-9-yldibenzofuran-4-yl)silane (CID 140811582) is (8-carbazol-9-yldibenzofuran-4-yl)-diphenyl-(8-pyrido[2,3-b]indol-9-yldibenzofuran-4-yl)silane.

What is the SMILES notation for (8-carbazol-9-yldibenzofuran-4-yl)-diphenyl-(8-pyrido[2,3-b]indol-9-yldibenzofuran-4-yl)silane?

The canonical SMILES for (8-carbazol-9-yldibenzofuran-4-yl)-diphenyl-(8-pyrido[2,3-b]indol-9-yldibenzofuran-4-yl)silane is c1ccc([Si](c2ccccc2)(c2cccc3c2oc2ccc(-n4c5ccccc5c5ccccc54)cc23)c2cccc3c2oc2ccc(-n4c5ccccc5c5cccnc54)cc23)cc1.

What is the InChIKey of (8-carbazol-9-yldibenzofuran-4-yl)-diphenyl-(8-pyrido[2,3-b]indol-9-yldibenzofuran-4-yl)silane?

The InChIKey is NFLZKXLERPDTDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C59H37N3O2Si/c1-3-16-40(17-4-1)65(41-18-5-2-6-19-41,55-29-13-23-45-48-36-38(31-33-53(48)63-57(45)55)61-50-26-10-7-20-42(50)43-21-8-11-27-51(43)61)56-30-14-24-46-49-37-39(32-34-54(49)64-58(46)56)62-52-28-12-9-22-44(52)47-25-15-35-60-59(47)62/h1-37H.

What are the key properties of (8-carbazol-9-yldibenzofuran-4-yl)-diphenyl-(8-pyrido[2,3-b]indol-9-yldibenzofuran-4-yl)silane?

(8-carbazol-9-yldibenzofuran-4-yl)-diphenyl-(8-pyrido[2,3-b]indol-9-yldibenzofuran-4-yl)silane has a molecular weight of 848.05 g/mol, XLogP of 12.45, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for (8-carbazol-9-yldibenzofuran-4-yl)-diphenyl-(8-pyrido[2,3-b]indol-9-yldibenzofuran-4-yl)silane is sourced from PubChem (CID 140811582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).