2,3-bis(4-fluorophenyl)-5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)quinoxaline;2,3-bis(4-methoxyphenyl)-5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)quinoxaline;5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)-2,3-bis(4-phenylphenyl)quinoxaline;5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)-2,3-dinaphthalen-1-ylquinoxaline

C254H262F2N8O2S8Si4 — CID 157424033

IUPAC2,3-bis(4-fluorophenyl)-5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)quinoxaline;2,3-bis(4-methoxyphenyl)-5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)quinoxaline;5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)-2,3-bis(4-phenylphenyl)quinoxaline;5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)-2,3-dinaphthalen-1-ylquinoxaline
SMILESCCCCCCCC[Si]1(CCCCCCCC)c2cc(C)ccc2-c2ccc(-c3ccc(-c4ccc(-c5ccc(C)s5)c5nc(-c6ccc(-c7ccccc7)cc6)c(-c6ccc(-c7ccccc7)cc6)nc45)s3)cc21.CCCCCCCC[Si]1(CCCCCCCC)c2cc(C)ccc2-c2ccc(-c3ccc(-c4ccc(-c5ccc(C)s5)c5nc(-c6ccc(F)cc6)c(-c6ccc(F)cc6)nc45)s3)cc21.CCCCCCCC[Si]1(CCCCCCCC)c2cc(C)ccc2-c2ccc(-c3ccc(-c4ccc(-c5ccc(C)s5)c5nc(-c6ccc(OC)cc6)c(-c6ccc(OC)cc6)nc45)s3)cc21.CCCCCCCC[Si]1(CCCCCCCC)c2cc(C)ccc2-c2ccc(-c3ccc(-c4ccc(-c5ccc(C)s5)c5nc(-c6cccc7ccccc67)c(-c6cccc7ccccc67)nc45)s3)cc21
InChIInChI=1S/C70H70N2S2Si.C66H66N2S2Si.C60H66N2O2S2Si.C58H60F2N2S2Si/c1-5-7-9-11-13-21-45-75(46-22-14-12-10-8-6-2)65-47-49(3)27-38-58(65)59-39-37-57(48-66(59)75)62-43-44-64(74-62)61-41-40-60(63-42-28-50(4)73-63)69-70(61)72-68(56-35-31-54(32-36-56)52-25-19-16-20-26-52)67(71-69)55-33-29-53(30-34-55)51-23-17-15-18-24-51;1-5-7-9-11-13-19-41-71(42-20-14-12-10-8-6-2)61-43-45(3)31-34-52(61)53-35-33-49(44-62(53)71)58-39-40-60(70-58)57-37-36-56(59-38-32-46(4)69-59)65-66(57)68-64(55-30-22-26-48-24-16-18-28-51(48)55)63(67-65)54-29-21-25-47-23-15-17-27-50(47)54;1-7-9-11-13-15-17-37-67(38-18-16-14-12-10-8-2)55-39-41(3)19-30-48(55)49-31-25-45(40-56(49)67)52-35-36-54(66-52)51-33-32-50(53-34-20-42(4)65-53)59-60(51)62-58(44-23-28-47(64-6)29-24-44)57(61-59)43-21-26-46(63-5)27-22-43;1-5-7-9-11-13-15-35-65(36-16-14-12-10-8-6-2)53-37-39(3)17-28-46(53)47-29-23-43(38-54(47)65)50-33-34-52(64-50)49-31-30-48(51-32-18-40(4)63-51)57-58(49)62-56(42-21-26-45(60)27-22-42)55(61-57)41-19-24-44(59)25-20-41/h15-20,23-44,47-48H,5-14,21-22,45-46H2,1-4H3;15-18,21-40,43-44H,5-14,19-20,41-42H2,1-4H3;19-36,39-40H,7-18,37-38H2,1-6H3;17-34,37-38H,5-16,35-36H2,1-4H3
InChIKeyBPTCMXJAJVKILK-UHFFFAOYSA-N
MW3865.82 g/mol
LogP73.81
Rot. Bonds80

About 2,3-bis(4-fluorophenyl)-5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)quinoxaline;2,3-bis(4-methoxyphenyl)-5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)quinoxaline;5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)-2,3-bis(4-phenylphenyl)quinoxaline;5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)-2,3-dinaphthalen-1-ylquinoxaline

2,3-bis(4-fluorophenyl)-5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)quinoxaline;2,3-bis(4-methoxyphenyl)-5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)quinoxaline;5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)-2,3-bis(4-phenylphenyl)quinoxaline;5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)-2,3-dinaphthalen-1-ylquinoxaline (PubChem CID 157424033) has the molecular formula C254H262F2N8O2S8Si4 and a molecular weight of 3865.82 g/mol. Its IUPAC name is 2,3-bis(4-fluorophenyl)-5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)quinoxaline;2,3-bis(4-methoxyphenyl)-5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)quinoxaline;5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)-2,3-bis(4-phenylphenyl)quinoxaline;5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)-2,3-dinaphthalen-1-ylquinoxaline.

Molecular Properties

Compound Name2,3-bis(4-fluorophenyl)-5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)quinoxaline;2,3-bis(4-methoxyphenyl)-5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)quinoxaline;5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)-2,3-bis(4-phenylphenyl)quinoxaline;5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)-2,3-dinaphthalen-1-ylquinoxaline
PubChem CID157424033
Molecular FormulaC254H262F2N8O2S8Si4
Molecular Weight3865.82 g/mol
Exact Mass3861.75
IUPAC Name2,3-bis(4-fluorophenyl)-5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)quinoxaline;2,3-bis(4-methoxyphenyl)-5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)quinoxaline;5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)-2,3-bis(4-phenylphenyl)quinoxaline;5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)-2,3-dinaphthalen-1-ylquinoxaline
SMILESCCCCCCCC[Si]1(CCCCCCCC)c2cc(C)ccc2-c2ccc(-c3ccc(-c4ccc(-c5ccc(C)s5)c5nc(-c6ccc(-c7ccccc7)cc6)c(-c6ccc(-c7ccccc7)cc6)nc45)s3)cc21.CCCCCCCC[Si]1(CCCCCCCC)c2cc(C)ccc2-c2ccc(-c3ccc(-c4ccc(-c5ccc(C)s5)c5nc(-c6ccc(F)cc6)c(-c6ccc(F)cc6)nc45)s3)cc21.CCCCCCCC[Si]1(CCCCCCCC)c2cc(C)ccc2-c2ccc(-c3ccc(-c4ccc(-c5ccc(C)s5)c5nc(-c6ccc(OC)cc6)c(-c6ccc(OC)cc6)nc45)s3)cc21.CCCCCCCC[Si]1(CCCCCCCC)c2cc(C)ccc2-c2ccc(-c3ccc(-c4ccc(-c5ccc(C)s5)c5nc(-c6cccc7ccccc67)c(-c6cccc7ccccc67)nc45)s3)cc21
InChIInChI=1S/C70H70N2S2Si.C66H66N2S2Si.C60H66N2O2S2Si.C58H60F2N2S2Si/c1-5-7-9-11-13-21-45-75(46-22-14-12-10-8-6-2)65-47-49(3)27-38-58(65)59-39-37-57(48-66(59)75)62-43-44-64(74-62)61-41-40-60(63-42-28-50(4)73-63)69-70(61)72-68(56-35-31-54(32-36-56)52-25-19-16-20-26-52)67(71-69)55-33-29-53(30-34-55)51-23-17-15-18-24-51;1-5-7-9-11-13-19-41-71(42-20-14-12-10-8-6-2)61-43-45(3)31-34-52(61)53-35-33-49(44-62(53)71)58-39-40-60(70-58)57-37-36-56(59-38-32-46(4)69-59)65-66(57)68-64(55-30-22-26-48-24-16-18-28-51(48)55)63(67-65)54-29-21-25-47-23-15-17-27-50(47)54;1-7-9-11-13-15-17-37-67(38-18-16-14-12-10-8-2)55-39-41(3)19-30-48(55)49-31-25-45(40-56(49)67)52-35-36-54(66-52)51-33-32-50(53-34-20-42(4)65-53)59-60(51)62-58(44-23-28-47(64-6)29-24-44)57(61-59)43-21-26-46(63-5)27-22-43;1-5-7-9-11-13-15-35-65(36-16-14-12-10-8-6-2)53-37-39(3)17-28-46(53)47-29-23-43(38-54(47)65)50-33-34-52(64-50)49-31-30-48(51-32-18-40(4)63-51)57-58(49)62-56(42-21-26-45(60)27-22-42)55(61-57)41-19-24-44(59)25-20-41/h15-20,23-44,47-48H,5-14,21-22,45-46H2,1-4H3;15-18,21-40,43-44H,5-14,19-20,41-42H2,1-4H3;19-36,39-40H,7-18,37-38H2,1-6H3;17-34,37-38H,5-16,35-36H2,1-4H3
InChIKeyBPTCMXJAJVKILK-UHFFFAOYSA-N
XLogP73.81
TPSA121.58 Ų
H-Bond Donors
H-Bond Acceptors18
Rotatable Bonds80
Heavy Atoms278
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003865.82
LogP ≤ 573.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1018

Computed Properties (RDKit)

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

Analyze 2,3-bis(4-fluorophenyl)-5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)quinoxaline;2,3-bis(4-methoxyphenyl)-5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)quinoxaline;5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)-2,3-bis(4-phenylphenyl)quinoxaline;5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)-2,3-dinaphthalen-1-ylquinoxaline with MolForge

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Related Compounds

6,7-Difluoro-2,3-bis(4-methoxyphenyl)-5-[5-(7-methyl-9,9-dioctylfluoren-2-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)quinoxaline
CID 58500549
2,3-Bis(4-hexoxyphenyl)-5-[5-(5-methyl-3-octylthiophen-2-yl)thiophen-2-yl]-8-[5-[3-octyl-5-(2,3,5,6-tetrafluoro-4-methylphenyl)thiophen-2-yl]thiophen-2-yl]quinoxaline
CID 59718123
5-[4,8-Bis[5-(2-ethylhexyl)-4-fluorothiophen-2-yl]-6-methylthieno[2,3-f][1]benzothiol-2-yl]-8-[5-[4-[5-[6,7-difluoro-8-methyl-3-(3-methylphenyl)-2-(3-octoxyphenyl)quinoxalin-5-yl]thiophen-2-yl]-2,5-difluorophenyl]thiophen-2-yl]-6,7-difluoro-2,3-bis(3-octoxyphenyl)quinoxaline
CID 158343941
5-[4,8-Bis[5-(2-ethylhexyl)-4-fluorothiophen-2-yl]-6-methylthieno[2,3-f][1]benzothiol-2-yl]-8-[5-[2,5-difluoro-4-[5-[8-methyl-3-(3-methylphenyl)-2-(3-octoxyphenyl)quinoxalin-5-yl]thiophen-2-yl]phenyl]thiophen-2-yl]-2,3-bis(3-octoxyphenyl)quinoxaline
CID 160919921
17,19-Bis[9,9-bis[4-(4-ethenylphenoxy)phenyl]fluoren-4-yl]-4,11-bis[2-(9,9'-spirobi[fluorene]-4'-yl)phenyl]-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene;17,19-bis(9,9-dimethylfluoren-4-yl)-4,11-bis(2-phenanthren-2-ylphenyl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene;4,11-bis[2-(4-phenylphenyl)phenyl]-17,19-bis(9,9'-spirobi[fluorene]-4'-yl)-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene;4-[2-(2-methylphenyl)phenyl]-17,19-bis(9,9'-spirobi[fluorene]-4'-yl)-11-[2-[2-(trifluoromethyl)phenyl]phenyl]-18-thia-15,21-diazapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(21),2(7),3,5,8(13),9,11,14,16,19-decaene
CID 160991121
2-[2-[5-[6,7-Difluoro-2,3-bis(4-octoxyphenyl)-8-thiophen-2-ylquinoxalin-5-yl]thiophen-2-yl]-4-[2-tri(propan-2-yl)silylethynyl]thieno[2,3-f][1]benzothiol-8-yl]ethynyl-tri(propan-2-yl)silane
CID 102104857
5-[5-[4,8-Bis[5-(2-ethylhexyl)thiophen-2-yl]thieno[2,3-f][1]benzothiol-2-yl]thiophen-2-yl]-6,7-difluoro-2,3-bis(3-octoxyphenyl)-8-thiophen-2-ylquinoxaline
CID 122379775
5-[5-[5-[4,8-Bis(5-hexylthiophen-2-yl)thieno[2,3-f][1]benzothiol-2-yl]thiophen-2-yl]thiophen-2-yl]-6,7-difluoro-2,3-bis(3-octoxyphenyl)-8-(5-thiophen-2-ylthiophen-2-yl)quinoxaline
CID 122379777
5-[5-[4,8-Bis[5-[5-(2-butyloctyl)thiophen-2-yl]thiophen-3-yl]thieno[2,3-f][1]benzothiol-2-yl]thiophen-2-yl]-6,7-difluoro-2,3-bis(3-octoxyphenyl)-8-thiophen-2-ylquinoxaline
CID 122403090
Tributyl-[5-[2-[8-[5-[2,3-difluoro-4-[5-[8-methyl-3-(3-methylphenyl)-2-(3-octoxyphenyl)quinoxalin-5-yl]thiophen-2-yl]phenyl]thiophen-2-yl]-3-(3-methylphenyl)-2-(3-octoxyphenyl)quinoxalin-5-yl]-6-methyl-4-(5-tributylsilylthiophen-2-yl)thieno[2,3-f][1]benzothiol-8-yl]thiophen-2-yl]silane
CID 157687319
8-[4,8-Bis[3-(2-ethylhexoxy)phenyl]-6-methylthieno[2,3-f][1]benzothiol-2-yl]-5-[5-[2,3-difluoro-4-[5-[8-methyl-3-(3-methylphenyl)-2-(3-octoxyphenyl)quinoxalin-5-yl]thiophen-2-yl]phenyl]thiophen-2-yl]-2-(3-methylphenyl)-3-(3-octoxyphenyl)quinoxaline
CID 158251608
8-[5-[4,8-Bis(5-methylthiophen-2-yl)-2-propan-2-ylthieno[2,3-f][1]benzothiol-6-yl]thiophen-2-yl]-6,7-difluoro-2-(3-methylphenyl)-3-(3-octoxyphenyl)-5-(5-propan-2-ylthiophen-2-yl)quinoxaline
CID 158525041

Frequently Asked Questions

What is the IUPAC name of 2,3-bis(4-fluorophenyl)-5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)quinoxaline;2,3-bis(4-methoxyphenyl)-5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)quinoxaline;5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)-2,3-bis(4-phenylphenyl)quinoxaline;5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)-2,3-dinaphthalen-1-ylquinoxaline?
The IUPAC name of 2,3-bis(4-fluorophenyl)-5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)quinoxaline;2,3-bis(4-methoxyphenyl)-5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)quinoxaline;5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)-2,3-bis(4-phenylphenyl)quinoxaline;5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)-2,3-dinaphthalen-1-ylquinoxaline (CID 157424033) is 2,3-bis(4-fluorophenyl)-5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)quinoxaline;2,3-bis(4-methoxyphenyl)-5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)quinoxaline;5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)-2,3-bis(4-phenylphenyl)quinoxaline;5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)-2,3-dinaphthalen-1-ylquinoxaline.
What is the SMILES notation for 2,3-bis(4-fluorophenyl)-5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)quinoxaline;2,3-bis(4-methoxyphenyl)-5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)quinoxaline;5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)-2,3-bis(4-phenylphenyl)quinoxaline;5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)-2,3-dinaphthalen-1-ylquinoxaline?
The canonical SMILES for 2,3-bis(4-fluorophenyl)-5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)quinoxaline;2,3-bis(4-methoxyphenyl)-5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)quinoxaline;5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)-2,3-bis(4-phenylphenyl)quinoxaline;5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)-2,3-dinaphthalen-1-ylquinoxaline is CCCCCCCC[Si]1(CCCCCCCC)c2cc(C)ccc2-c2ccc(-c3ccc(-c4ccc(-c5ccc(C)s5)c5nc(-c6ccc(-c7ccccc7)cc6)c(-c6ccc(-c7ccccc7)cc6)nc45)s3)cc21.CCCCCCCC[Si]1(CCCCCCCC)c2cc(C)ccc2-c2ccc(-c3ccc(-c4ccc(-c5ccc(C)s5)c5nc(-c6ccc(F)cc6)c(-c6ccc(F)cc6)nc45)s3)cc21.CCCCCCCC[Si]1(CCCCCCCC)c2cc(C)ccc2-c2ccc(-c3ccc(-c4ccc(-c5ccc(C)s5)c5nc(-c6ccc(OC)cc6)c(-c6ccc(OC)cc6)nc45)s3)cc21.CCCCCCCC[Si]1(CCCCCCCC)c2cc(C)ccc2-c2ccc(-c3ccc(-c4ccc(-c5ccc(C)s5)c5nc(-c6cccc7ccccc67)c(-c6cccc7ccccc67)nc45)s3)cc21.
What is the InChIKey of 2,3-bis(4-fluorophenyl)-5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)quinoxaline;2,3-bis(4-methoxyphenyl)-5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)quinoxaline;5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)-2,3-bis(4-phenylphenyl)quinoxaline;5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)-2,3-dinaphthalen-1-ylquinoxaline?
The InChIKey is BPTCMXJAJVKILK-UHFFFAOYSA-N. The full InChI is InChI=1S/C70H70N2S2Si.C66H66N2S2Si.C60H66N2O2S2Si.C58H60F2N2S2Si/c1-5-7-9-11-13-21-45-75(46-22-14-12-10-8-6-2)65-47-49(3)27-38-58(65)59-39-37-57(48-66(59)75)62-43-44-64(74-62)61-41-40-60(63-42-28-50(4)73-63)69-70(61)72-68(56-35-31-54(32-36-56)52-25-19-16-20-26-52)67(71-69)55-33-29-53(30-34-55)51-23-17-15-18-24-51;1-5-7-9-11-13-19-41-71(42-20-14-12-10-8-6-2)61-43-45(3)31-34-52(61)53-35-33-49(44-62(53)71)58-39-40-60(70-58)57-37-36-56(59-38-32-46(4)69-59)65-66(57)68-64(55-30-22-26-48-24-16-18-28-51(48)55)63(67-65)54-29-21-25-47-23-15-17-27-50(47)54;1-7-9-11-13-15-17-37-67(38-18-16-14-12-10-8-2)55-39-41(3)19-30-48(55)49-31-25-45(40-56(49)67)52-35-36-54(66-52)51-33-32-50(53-34-20-42(4)65-53)59-60(51)62-58(44-23-28-47(64-6)29-24-44)57(61-59)43-21-26-46(63-5)27-22-43;1-5-7-9-11-13-15-35-65(36-16-14-12-10-8-6-2)53-37-39(3)17-28-46(53)47-29-23-43(38-54(47)65)50-33-34-52(64-50)49-31-30-48(51-32-18-40(4)63-51)57-58(49)62-56(42-21-26-45(60)27-22-42)55(61-57)41-19-24-44(59)25-20-41/h15-20,23-44,47-48H,5-14,21-22,45-46H2,1-4H3;15-18,21-40,43-44H,5-14,19-20,41-42H2,1-4H3;19-36,39-40H,7-18,37-38H2,1-6H3;17-34,37-38H,5-16,35-36H2,1-4H3.
What are the key properties of 2,3-bis(4-fluorophenyl)-5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)quinoxaline;2,3-bis(4-methoxyphenyl)-5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)quinoxaline;5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)-2,3-bis(4-phenylphenyl)quinoxaline;5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)-2,3-dinaphthalen-1-ylquinoxaline?
2,3-bis(4-fluorophenyl)-5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)quinoxaline;2,3-bis(4-methoxyphenyl)-5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)quinoxaline;5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)-2,3-bis(4-phenylphenyl)quinoxaline;5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)-2,3-dinaphthalen-1-ylquinoxaline has a molecular weight of 3865.82 g/mol, XLogP of 73.81, 80 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-bis(4-fluorophenyl)-5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)quinoxaline;2,3-bis(4-methoxyphenyl)-5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)quinoxaline;5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)-2,3-bis(4-phenylphenyl)quinoxaline;5-[5-(7-methyl-5,5-dioctylbenzo[b][1]benzosilol-3-yl)thiophen-2-yl]-8-(5-methylthiophen-2-yl)-2,3-dinaphthalen-1-ylquinoxaline is sourced from PubChem (CID 157424033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).