9-naphthalen-2-yl-14-(3-naphthalen-2-ylquinoxalin-2-yl)-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;triphenyl-[3-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)quinoxalin-2-yl]phenyl]silane;triphenyl-[4-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)quinoxalin-2-yl]phenyl]silane

C158H104N12Si2 — CID 159524824

About 9-naphthalen-2-yl-14-(3-naphthalen-2-ylquinoxalin-2-yl)-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;triphenyl-[3-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)quinoxalin-2-yl]phenyl]silane;triphenyl-[4-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)quinoxalin-2-yl]phenyl]silane

9-naphthalen-2-yl-14-(3-naphthalen-2-ylquinoxalin-2-yl)-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;triphenyl-[3-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)quinoxalin-2-yl]phenyl]silane;triphenyl-[4-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)quinoxalin-2-yl]phenyl]silane (PubChem CID 159524824) has the molecular formula C158H104N12Si2 and a molecular weight of 2226.83 g/mol. Its IUPAC name is 9-naphthalen-2-yl-14-(3-naphthalen-2-ylquinoxalin-2-yl)-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;triphenyl-[3-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)quinoxalin-2-yl]phenyl]silane;triphenyl-[4-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)quinoxalin-2-yl]phenyl]silane.

Molecular Properties

• Compound Name: 9-naphthalen-2-yl-14-(3-naphthalen-2-ylquinoxalin-2-yl)-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;triphenyl-[3-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)quinoxalin-2-yl]phenyl]silane;triphenyl-[4-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)quinoxalin-2-yl]phenyl]silane
• PubChem CID: 159524824
• Molecular Formula: C158H104N12Si2
• Molecular Weight: 2226.83 g/mol
• Exact Mass: 2224.80
• IUPAC Name: 9-naphthalen-2-yl-14-(3-naphthalen-2-ylquinoxalin-2-yl)-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;triphenyl-[3-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)quinoxalin-2-yl]phenyl]silane;triphenyl-[4-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)quinoxalin-2-yl]phenyl]silane
• SMILES: c1ccc(-n2c3ccccc3c3c4c5ccccc5n(-c5nc6ccccc6nc5-c5ccc([Si](c6ccccc6)(c6ccccc6)c6ccccc6)cc5)c4ccc32)cc1.c1ccc(-n2c3ccccc3c3c4c5ccccc5n(-c5nc6ccccc6nc5-c5cccc([Si](c6ccccc6)(c6ccccc6)c6ccccc6)c5)c4ccc32)cc1.c1ccc2cc(-c3nc4ccccc4nc3-n3c4ccccc4c4c5c6ccccc6n(-c6ccc7ccccc7c6)c5ccc43)ccc2c1
• InChI: InChI=1S/2C56H38N4Si.C46H28N4/c1-5-21-40(22-6-1)59-49-34-17-13-30-45(49)53-51(59)36-37-52-54(53)46-31-14-18-35-50(46)60(52)56-55(57-47-32-15-16-33-48(47)58-56)39-20-19-29-44(38-39)61(41-23-7-2-8-24-41,42-25-9-3-10-26-42)43-27-11-4-12-28-43;1-5-19-40(20-6-1)59-49-31-17-13-27-45(49)53-51(59)37-38-52-54(53)46-28-14-18-32-50(46)60(52)56-55(57-47-29-15-16-30-48(47)58-56)39-33-35-44(36-34-39)61(41-21-7-2-8-22-41,42-23-9-3-10-24-42)43-25-11-4-12-26-43;1-3-13-31-27-33(22-21-29(31)11-1)45-46(48-38-18-8-7-17-37(38)47-45)50-40-20-10-6-16-36(40)44-42(50)26-25-41-43(44)35-15-5-9-19-39(35)49(41)34-24-23-30-12-2-4-14-32(30)28-34/h2*1-38H;1-28H
• InChIKey: MCGHEZAEYFTPPD-UHFFFAOYSA-N
• XLogP: 33.53
• TPSA: 106.92 Ų
• H-Bond Acceptors: 12
• Rotatable Bonds: 17
• Heavy Atoms: 172
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2226.83
LogP ≤ 5	33.53
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	12

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 9-naphthalen-2-yl-14-(3-naphthalen-2-ylquinoxalin-2-yl)-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;triphenyl-[3-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)quinoxalin-2-yl]phenyl]silane;triphenyl-[4-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)quinoxalin-2-yl]phenyl]silane?

The IUPAC name of 9-naphthalen-2-yl-14-(3-naphthalen-2-ylquinoxalin-2-yl)-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;triphenyl-[3-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)quinoxalin-2-yl]phenyl]silane;triphenyl-[4-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)quinoxalin-2-yl]phenyl]silane (CID 159524824) is 9-naphthalen-2-yl-14-(3-naphthalen-2-ylquinoxalin-2-yl)-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;triphenyl-[3-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)quinoxalin-2-yl]phenyl]silane;triphenyl-[4-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)quinoxalin-2-yl]phenyl]silane.

What is the SMILES notation for 9-naphthalen-2-yl-14-(3-naphthalen-2-ylquinoxalin-2-yl)-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;triphenyl-[3-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)quinoxalin-2-yl]phenyl]silane;triphenyl-[4-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)quinoxalin-2-yl]phenyl]silane?

The canonical SMILES for 9-naphthalen-2-yl-14-(3-naphthalen-2-ylquinoxalin-2-yl)-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;triphenyl-[3-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)quinoxalin-2-yl]phenyl]silane;triphenyl-[4-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)quinoxalin-2-yl]phenyl]silane is c1ccc(-n2c3ccccc3c3c4c5ccccc5n(-c5nc6ccccc6nc5-c5ccc([Si](c6ccccc6)(c6ccccc6)c6ccccc6)cc5)c4ccc32)cc1.c1ccc(-n2c3ccccc3c3c4c5ccccc5n(-c5nc6ccccc6nc5-c5cccc([Si](c6ccccc6)(c6ccccc6)c6ccccc6)c5)c4ccc32)cc1.c1ccc2cc(-c3nc4ccccc4nc3-n3c4ccccc4c4c5c6ccccc6n(-c6ccc7ccccc7c6)c5ccc43)ccc2c1.

What is the InChIKey of 9-naphthalen-2-yl-14-(3-naphthalen-2-ylquinoxalin-2-yl)-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;triphenyl-[3-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)quinoxalin-2-yl]phenyl]silane;triphenyl-[4-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)quinoxalin-2-yl]phenyl]silane?

The InChIKey is MCGHEZAEYFTPPD-UHFFFAOYSA-N. The full InChI is InChI=1S/2C56H38N4Si.C46H28N4/c1-5-21-40(22-6-1)59-49-34-17-13-30-45(49)53-51(59)36-37-52-54(53)46-31-14-18-35-50(46)60(52)56-55(57-47-32-15-16-33-48(47)58-56)39-20-19-29-44(38-39)61(41-23-7-2-8-24-41,42-25-9-3-10-26-42)43-27-11-4-12-28-43;1-5-19-40(20-6-1)59-49-31-17-13-27-45(49)53-51(59)37-38-52-54(53)46-28-14-18-32-50(46)60(52)56-55(57-47-29-15-16-30-48(47)58-56)39-33-35-44(36-34-39)61(41-21-7-2-8-22-41,42-23-9-3-10-24-42)43-25-11-4-12-26-43;1-3-13-31-27-33(22-21-29(31)11-1)45-46(48-38-18-8-7-17-37(38)47-45)50-40-20-10-6-16-36(40)44-42(50)26-25-41-43(44)35-15-5-9-19-39(35)49(41)34-24-23-30-12-2-4-14-32(30)28-34/h2*1-38H;1-28H.

What are the key properties of 9-naphthalen-2-yl-14-(3-naphthalen-2-ylquinoxalin-2-yl)-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;triphenyl-[3-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)quinoxalin-2-yl]phenyl]silane;triphenyl-[4-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)quinoxalin-2-yl]phenyl]silane?

9-naphthalen-2-yl-14-(3-naphthalen-2-ylquinoxalin-2-yl)-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;triphenyl-[3-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)quinoxalin-2-yl]phenyl]silane;triphenyl-[4-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)quinoxalin-2-yl]phenyl]silane has a molecular weight of 2226.83 g/mol, XLogP of 33.53, 17 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for 9-naphthalen-2-yl-14-(3-naphthalen-2-ylquinoxalin-2-yl)-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;triphenyl-[3-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)quinoxalin-2-yl]phenyl]silane;triphenyl-[4-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)quinoxalin-2-yl]phenyl]silane is sourced from PubChem (CID 159524824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).