3-[[3-([1]benzofuro[2,3-b]carbazol-7-yl)-5-isocyanophenyl]-diphenylsilyl]-5-carbazol-9-ylbenzonitrile;[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-(3-carbazol-9-ylphenyl)-dipyridin-2-ylsilane;[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-diphenyl-(3-pyrido[3,4-b]indol-9-ylphenyl)silane;9-[3-[[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-diphenylsilyl]phenyl]carbazole-3-carbonitrile

C216H138N14O4Si4 — CID 159404733

About 3-[[3-([1]benzofuro[2,3-b]carbazol-7-yl)-5-isocyanophenyl]-diphenylsilyl]-5-carbazol-9-ylbenzonitrile;[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-(3-carbazol-9-ylphenyl)-dipyridin-2-ylsilane;[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-diphenyl-(3-pyrido[3,4-b]indol-9-ylphenyl)silane;9-[3-[[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-diphenylsilyl]phenyl]carbazole-3-carbonitrile

3-[[3-([1]benzofuro[2,3-b]carbazol-7-yl)-5-isocyanophenyl]-diphenylsilyl]-5-carbazol-9-ylbenzonitrile;[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-(3-carbazol-9-ylphenyl)-dipyridin-2-ylsilane;[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-diphenyl-(3-pyrido[3,4-b]indol-9-ylphenyl)silane;9-[3-[[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-diphenylsilyl]phenyl]carbazole-3-carbonitrile (PubChem CID 159404733) has the molecular formula C216H138N14O4Si4 and a molecular weight of 3105.92 g/mol. Its IUPAC name is 3-[[3-([1]benzofuro[2,3-b]carbazol-7-yl)-5-isocyanophenyl]-diphenylsilyl]-5-carbazol-9-ylbenzonitrile;[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-(3-carbazol-9-ylphenyl)-dipyridin-2-ylsilane;[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-diphenyl-(3-pyrido[3,4-b]indol-9-ylphenyl)silane;9-[3-[[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-diphenylsilyl]phenyl]carbazole-3-carbonitrile.

Molecular Properties

• Compound Name: 3-[[3-([1]benzofuro[2,3-b]carbazol-7-yl)-5-isocyanophenyl]-diphenylsilyl]-5-carbazol-9-ylbenzonitrile;[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-(3-carbazol-9-ylphenyl)-dipyridin-2-ylsilane;[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-diphenyl-(3-pyrido[3,4-b]indol-9-ylphenyl)silane;9-[3-[[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-diphenylsilyl]phenyl]carbazole-3-carbonitrile
• PubChem CID: 159404733
• Molecular Formula: C216H138N14O4Si4
• Molecular Weight: 3105.92 g/mol
• Exact Mass: 3103.01
• IUPAC Name: 3-[[3-([1]benzofuro[2,3-b]carbazol-7-yl)-5-isocyanophenyl]-diphenylsilyl]-5-carbazol-9-ylbenzonitrile;[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-(3-carbazol-9-ylphenyl)-dipyridin-2-ylsilane;[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-diphenyl-(3-pyrido[3,4-b]indol-9-ylphenyl)silane;9-[3-[[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-diphenylsilyl]phenyl]carbazole-3-carbonitrile
• SMILES: N#Cc1ccc2c(c1)c1ccccc1n2-c1cccc([Si](c2ccccc2)(c2ccccc2)c2cccc(-n3c4ccccc4c4cc5c(cc43)oc3ccccc35)c2)c1.[C-]#[N+]c1cc(-n2c3ccccc3c3cc4c(cc32)oc2ccccc24)cc([Si](c2ccccc2)(c2ccccc2)c2cc(C#N)cc(-n3c4ccccc4c4ccccc43)c2)c1.c1ccc([Si](c2cccc(-n3c4ccccc4c4ccccc43)c2)(c2cccc(-n3c4ccccc4c4cc5c(cc43)oc3ccccc35)c2)c2ccccn2)nc1.c1ccc([Si](c2ccccc2)(c2cccc(-n3c4ccccc4c4ccncc43)c2)c2cccc(-n3c4ccccc4c4cc5c(cc43)oc3ccccc35)c2)cc1
• InChI: InChI=1S/C56H34N4OSi.C55H35N3OSi.C53H35N3OSi.C52H34N4OSi/c1-58-38-30-40(60-53-26-14-10-22-47(53)49-34-50-48-23-11-15-27-55(48)61-56(50)35-54(49)60)33-44(31-38)62(41-16-4-2-5-17-41,42-18-6-3-7-19-42)43-29-37(36-57)28-39(32-43)59-51-24-12-8-20-45(51)46-21-9-13-25-52(46)59;56-36-37-29-30-52-47(31-37)44-23-7-10-26-50(44)57(52)38-15-13-21-42(32-38)60(40-17-3-1-4-18-40,41-19-5-2-6-20-41)43-22-14-16-39(33-43)58-51-27-11-8-24-45(51)48-34-49-46-25-9-12-28-54(46)59-55(49)35-53(48)58;1-3-17-38(18-4-1)58(39-19-5-2-6-20-39,41-22-14-16-37(32-41)56-48-26-10-7-23-42(48)44-29-30-54-35-51(44)56)40-21-13-15-36(31-40)55-49-27-11-8-24-43(49)46-33-47-45-25-9-12-28-52(45)57-53(47)34-50(46)55;1-5-23-45-39(19-1)40-20-2-6-24-46(40)55(45)35-15-13-17-37(31-35)58(51-27-9-11-29-53-51,52-28-10-12-30-54-52)38-18-14-16-36(32-38)56-47-25-7-3-21-41(47)43-33-44-42-22-4-8-26-49(42)57-50(44)34-48(43)56/h2-35H;1-35H;1-35H;1-34H
• InChIKey: LNUPGNRBKAVUKC-UHFFFAOYSA-N
• XLogP: 43.11
• TPSA: 182.61 Ų
• H-Bond Acceptors: 17
• Rotatable Bonds: 24
• Heavy Atoms: 238
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3105.92
LogP ≤ 5	43.11
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	17

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 3-[[3-([1]benzofuro[2,3-b]carbazol-7-yl)-5-isocyanophenyl]-diphenylsilyl]-5-carbazol-9-ylbenzonitrile;[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-(3-carbazol-9-ylphenyl)-dipyridin-2-ylsilane;[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-diphenyl-(3-pyrido[3,4-b]indol-9-ylphenyl)silane;9-[3-[[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-diphenylsilyl]phenyl]carbazole-3-carbonitrile?

The IUPAC name of 3-[[3-([1]benzofuro[2,3-b]carbazol-7-yl)-5-isocyanophenyl]-diphenylsilyl]-5-carbazol-9-ylbenzonitrile;[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-(3-carbazol-9-ylphenyl)-dipyridin-2-ylsilane;[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-diphenyl-(3-pyrido[3,4-b]indol-9-ylphenyl)silane;9-[3-[[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-diphenylsilyl]phenyl]carbazole-3-carbonitrile (CID 159404733) is 3-[[3-([1]benzofuro[2,3-b]carbazol-7-yl)-5-isocyanophenyl]-diphenylsilyl]-5-carbazol-9-ylbenzonitrile;[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-(3-carbazol-9-ylphenyl)-dipyridin-2-ylsilane;[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-diphenyl-(3-pyrido[3,4-b]indol-9-ylphenyl)silane;9-[3-[[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-diphenylsilyl]phenyl]carbazole-3-carbonitrile.

What is the SMILES notation for 3-[[3-([1]benzofuro[2,3-b]carbazol-7-yl)-5-isocyanophenyl]-diphenylsilyl]-5-carbazol-9-ylbenzonitrile;[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-(3-carbazol-9-ylphenyl)-dipyridin-2-ylsilane;[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-diphenyl-(3-pyrido[3,4-b]indol-9-ylphenyl)silane;9-[3-[[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-diphenylsilyl]phenyl]carbazole-3-carbonitrile?

The canonical SMILES for 3-[[3-([1]benzofuro[2,3-b]carbazol-7-yl)-5-isocyanophenyl]-diphenylsilyl]-5-carbazol-9-ylbenzonitrile;[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-(3-carbazol-9-ylphenyl)-dipyridin-2-ylsilane;[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-diphenyl-(3-pyrido[3,4-b]indol-9-ylphenyl)silane;9-[3-[[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-diphenylsilyl]phenyl]carbazole-3-carbonitrile is N#Cc1ccc2c(c1)c1ccccc1n2-c1cccc([Si](c2ccccc2)(c2ccccc2)c2cccc(-n3c4ccccc4c4cc5c(cc43)oc3ccccc35)c2)c1.[C-]#[N+]c1cc(-n2c3ccccc3c3cc4c(cc32)oc2ccccc24)cc([Si](c2ccccc2)(c2ccccc2)c2cc(C#N)cc(-n3c4ccccc4c4ccccc43)c2)c1.c1ccc([Si](c2cccc(-n3c4ccccc4c4ccccc43)c2)(c2cccc(-n3c4ccccc4c4cc5c(cc43)oc3ccccc35)c2)c2ccccn2)nc1.c1ccc([Si](c2ccccc2)(c2cccc(-n3c4ccccc4c4ccncc43)c2)c2cccc(-n3c4ccccc4c4cc5c(cc43)oc3ccccc35)c2)cc1.

What is the InChIKey of 3-[[3-([1]benzofuro[2,3-b]carbazol-7-yl)-5-isocyanophenyl]-diphenylsilyl]-5-carbazol-9-ylbenzonitrile;[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-(3-carbazol-9-ylphenyl)-dipyridin-2-ylsilane;[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-diphenyl-(3-pyrido[3,4-b]indol-9-ylphenyl)silane;9-[3-[[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-diphenylsilyl]phenyl]carbazole-3-carbonitrile?

The InChIKey is LNUPGNRBKAVUKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H34N4OSi.C55H35N3OSi.C53H35N3OSi.C52H34N4OSi/c1-58-38-30-40(60-53-26-14-10-22-47(53)49-34-50-48-23-11-15-27-55(48)61-56(50)35-54(49)60)33-44(31-38)62(41-16-4-2-5-17-41,42-18-6-3-7-19-42)43-29-37(36-57)28-39(32-43)59-51-24-12-8-20-45(51)46-21-9-13-25-52(46)59;56-36-37-29-30-52-47(31-37)44-23-7-10-26-50(44)57(52)38-15-13-21-42(32-38)60(40-17-3-1-4-18-40,41-19-5-2-6-20-41)43-22-14-16-39(33-43)58-51-27-11-8-24-45(51)48-34-49-46-25-9-12-28-54(46)59-55(49)35-53(48)58;1-3-17-38(18-4-1)58(39-19-5-2-6-20-39,41-22-14-16-37(32-41)56-48-26-10-7-23-42(48)44-29-30-54-35-51(44)56)40-21-13-15-36(31-40)55-49-27-11-8-24-43(49)46-33-47-45-25-9-12-28-52(45)57-53(47)34-50(46)55;1-5-23-45-39(19-1)40-20-2-6-24-46(40)55(45)35-15-13-17-37(31-35)58(51-27-9-11-29-53-51,52-28-10-12-30-54-52)38-18-14-16-36(32-38)56-47-25-7-3-21-41(47)43-33-44-42-22-4-8-26-49(42)57-50(44)34-48(43)56/h2-35H;1-35H;1-35H;1-34H.

What are the key properties of 3-[[3-([1]benzofuro[2,3-b]carbazol-7-yl)-5-isocyanophenyl]-diphenylsilyl]-5-carbazol-9-ylbenzonitrile;[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-(3-carbazol-9-ylphenyl)-dipyridin-2-ylsilane;[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-diphenyl-(3-pyrido[3,4-b]indol-9-ylphenyl)silane;9-[3-[[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-diphenylsilyl]phenyl]carbazole-3-carbonitrile?

3-[[3-([1]benzofuro[2,3-b]carbazol-7-yl)-5-isocyanophenyl]-diphenylsilyl]-5-carbazol-9-ylbenzonitrile;[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-(3-carbazol-9-ylphenyl)-dipyridin-2-ylsilane;[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-diphenyl-(3-pyrido[3,4-b]indol-9-ylphenyl)silane;9-[3-[[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-diphenylsilyl]phenyl]carbazole-3-carbonitrile has a molecular weight of 3105.92 g/mol, XLogP of 43.11, 24 rotatable bonds, 0 hydrogen bond donors, and 17 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[[3-([1]benzofuro[2,3-b]carbazol-7-yl)-5-isocyanophenyl]-diphenylsilyl]-5-carbazol-9-ylbenzonitrile;[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-(3-carbazol-9-ylphenyl)-dipyridin-2-ylsilane;[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-diphenyl-(3-pyrido[3,4-b]indol-9-ylphenyl)silane;9-[3-[[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-diphenylsilyl]phenyl]carbazole-3-carbonitrile is sourced from PubChem (CID 159404733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).