[6-[2,6-bis[3,6-bis(trifluoromethyl)carbazol-9-yl]-10-(5-trimethylsilyl-2-pyridinyl)anthracen-9-yl]-3-pyridinyl]-trimethylsilane;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(5-tert-butyl-2-pyridinyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole

C118H84F24N8Si2 — CID 158545175

IUPAC[6-[2,6-bis[3,6-bis(trifluoromethyl)carbazol-9-yl]-10-(5-trimethylsilyl-2-pyridinyl)anthracen-9-yl]-3-pyridinyl]-trimethylsilane;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(5-tert-butyl-2-pyridinyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole
SMILESCC(C)(C)c1ccc(-c2c3ccc(-n4c5ccc(C(F)(F)F)cc5c5cc(C(F)(F)F)ccc54)cc3c(-c3ccc(C(C)(C)C)cn3)c3ccc(-n4c5ccc(C(F)(F)F)cc5c5cc(C(F)(F)F)ccc54)cc23)nc1.C[Si](C)(C)c1ccc(-c2c3ccc(-n4c5ccc(C(F)(F)F)cc5c5cc(C(F)(F)F)ccc54)cc3c(-c3ccc([Si](C)(C)C)cn3)c3ccc(-n4c5ccc(C(F)(F)F)cc5c5cc(C(F)(F)F)ccc54)cc23)nc1
InChIInChI=1S/C60H42F12N4.C58H42F12N4Si2/c1-55(2,3)35-7-17-47(73-29-35)53-39-15-13-38(76-51-21-11-33(59(67,68)69)25-43(51)44-26-34(60(70,71)72)12-22-52(44)76)28-46(39)54(48-18-8-36(30-74-48)56(4,5)6)40-16-14-37(27-45(40)53)75-49-19-9-31(57(61,62)63)23-41(49)42-24-32(58(64,65)66)10-20-50(42)75;1-75(2,3)37-13-17-47(71-29-37)53-39-15-11-36(74-51-21-9-33(57(65,66)67)25-43(51)44-26-34(58(68,69)70)10-22-52(44)74)28-46(39)54(48-18-14-38(30-72-48)76(4,5)6)40-16-12-35(27-45(40)53)73-49-19-7-31(55(59,60)61)23-41(49)42-24-32(56(62,63)64)8-20-50(42)73/h2*7-30H,1-6H3
InChIKeyHPAGBCVIEGAWGX-UHFFFAOYSA-N
MW2126.15 g/mol
LogP36.46
Rot. Bonds10

About [6-[2,6-bis[3,6-bis(trifluoromethyl)carbazol-9-yl]-10-(5-trimethylsilyl-2-pyridinyl)anthracen-9-yl]-3-pyridinyl]-trimethylsilane;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(5-tert-butyl-2-pyridinyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole

[6-[2,6-bis[3,6-bis(trifluoromethyl)carbazol-9-yl]-10-(5-trimethylsilyl-2-pyridinyl)anthracen-9-yl]-3-pyridinyl]-trimethylsilane;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(5-tert-butyl-2-pyridinyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole (PubChem CID 158545175) has the molecular formula C118H84F24N8Si2 and a molecular weight of 2126.15 g/mol. Its IUPAC name is [6-[2,6-bis[3,6-bis(trifluoromethyl)carbazol-9-yl]-10-(5-trimethylsilyl-2-pyridinyl)anthracen-9-yl]-3-pyridinyl]-trimethylsilane;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(5-tert-butyl-2-pyridinyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole.

Molecular Properties

Compound Name[6-[2,6-bis[3,6-bis(trifluoromethyl)carbazol-9-yl]-10-(5-trimethylsilyl-2-pyridinyl)anthracen-9-yl]-3-pyridinyl]-trimethylsilane;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(5-tert-butyl-2-pyridinyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole
PubChem CID158545175
Molecular FormulaC118H84F24N8Si2
Molecular Weight2126.15 g/mol
Exact Mass2124.60
IUPAC Name[6-[2,6-bis[3,6-bis(trifluoromethyl)carbazol-9-yl]-10-(5-trimethylsilyl-2-pyridinyl)anthracen-9-yl]-3-pyridinyl]-trimethylsilane;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(5-tert-butyl-2-pyridinyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole
SMILESCC(C)(C)c1ccc(-c2c3ccc(-n4c5ccc(C(F)(F)F)cc5c5cc(C(F)(F)F)ccc54)cc3c(-c3ccc(C(C)(C)C)cn3)c3ccc(-n4c5ccc(C(F)(F)F)cc5c5cc(C(F)(F)F)ccc54)cc23)nc1.C[Si](C)(C)c1ccc(-c2c3ccc(-n4c5ccc(C(F)(F)F)cc5c5cc(C(F)(F)F)ccc54)cc3c(-c3ccc([Si](C)(C)C)cn3)c3ccc(-n4c5ccc(C(F)(F)F)cc5c5cc(C(F)(F)F)ccc54)cc23)nc1
InChIInChI=1S/C60H42F12N4.C58H42F12N4Si2/c1-55(2,3)35-7-17-47(73-29-35)53-39-15-13-38(76-51-21-11-33(59(67,68)69)25-43(51)44-26-34(60(70,71)72)12-22-52(44)76)28-46(39)54(48-18-8-36(30-74-48)56(4,5)6)40-16-14-37(27-45(40)53)75-49-19-9-31(57(61,62)63)23-41(49)42-24-32(58(64,65)66)10-20-50(42)75;1-75(2,3)37-13-17-47(71-29-37)53-39-15-11-36(74-51-21-9-33(57(65,66)67)25-43(51)44-26-34(58(68,69)70)10-22-52(44)74)28-46(39)54(48-18-14-38(30-72-48)76(4,5)6)40-16-12-35(27-45(40)53)73-49-19-7-31(55(59,60)61)23-41(49)42-24-32(56(62,63)64)8-20-50(42)73/h2*7-30H,1-6H3
InChIKeyHPAGBCVIEGAWGX-UHFFFAOYSA-N
XLogP36.46
TPSA71.28 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds10
Heavy Atoms152
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002126.15
LogP ≤ 536.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

Analyze [6-[2,6-bis[3,6-bis(trifluoromethyl)carbazol-9-yl]-10-(5-trimethylsilyl-2-pyridinyl)anthracen-9-yl]-3-pyridinyl]-trimethylsilane;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(5-tert-butyl-2-pyridinyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole with MolForge

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Related Compounds

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CID 57976901
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CID 58401848
8-[2-Methyl-5-(trifluoromethyl)-4-[5-[4-[2,4,6-tris(trifluoromethyl)phenyl]phenyl]pyrido[4,3-b]indol-8-yl]phenyl]-5-[4-[2,4,6-tris(trifluoromethyl)phenyl]phenyl]pyrido[4,3-b]indole
CID 58939538
8-[2,5-Bis(trifluoromethyl)-4-[5-[4-[2,4,6-tris(trifluoromethyl)phenyl]phenyl]pyrido[4,3-b]indol-8-yl]phenyl]-5-[4-[2,4,6-tris(trifluoromethyl)phenyl]phenyl]pyrido[4,3-b]indole
CID 59344193
9-[6-(3,6-Difluorocarbazol-9-yl)-9,10-di(isoquinolin-1-yl)anthracen-2-yl]-3,6-difluorocarbazole
CID 59357109
9-[6-[3,6-Bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(4-pyridin-2-ylphenyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole
CID 59357111
[6-[2,6-Bis[3,6-bis(trifluoromethyl)carbazol-9-yl]-10-(5-trimethylsilylpyridin-2-yl)anthracen-9-yl]pyridin-3-yl]-trimethylsilane
CID 59357121
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9-[6-[3,6-Bis(trifluoromethyl)carbazol-9-yl]-9,10-dipyridin-3-ylanthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole
CID 59357152

Frequently Asked Questions

What is the IUPAC name of [6-[2,6-bis[3,6-bis(trifluoromethyl)carbazol-9-yl]-10-(5-trimethylsilyl-2-pyridinyl)anthracen-9-yl]-3-pyridinyl]-trimethylsilane;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(5-tert-butyl-2-pyridinyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole?
The IUPAC name of [6-[2,6-bis[3,6-bis(trifluoromethyl)carbazol-9-yl]-10-(5-trimethylsilyl-2-pyridinyl)anthracen-9-yl]-3-pyridinyl]-trimethylsilane;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(5-tert-butyl-2-pyridinyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole (CID 158545175) is [6-[2,6-bis[3,6-bis(trifluoromethyl)carbazol-9-yl]-10-(5-trimethylsilyl-2-pyridinyl)anthracen-9-yl]-3-pyridinyl]-trimethylsilane;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(5-tert-butyl-2-pyridinyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole.
What is the SMILES notation for [6-[2,6-bis[3,6-bis(trifluoromethyl)carbazol-9-yl]-10-(5-trimethylsilyl-2-pyridinyl)anthracen-9-yl]-3-pyridinyl]-trimethylsilane;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(5-tert-butyl-2-pyridinyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole?
The canonical SMILES for [6-[2,6-bis[3,6-bis(trifluoromethyl)carbazol-9-yl]-10-(5-trimethylsilyl-2-pyridinyl)anthracen-9-yl]-3-pyridinyl]-trimethylsilane;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(5-tert-butyl-2-pyridinyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole is CC(C)(C)c1ccc(-c2c3ccc(-n4c5ccc(C(F)(F)F)cc5c5cc(C(F)(F)F)ccc54)cc3c(-c3ccc(C(C)(C)C)cn3)c3ccc(-n4c5ccc(C(F)(F)F)cc5c5cc(C(F)(F)F)ccc54)cc23)nc1.C[Si](C)(C)c1ccc(-c2c3ccc(-n4c5ccc(C(F)(F)F)cc5c5cc(C(F)(F)F)ccc54)cc3c(-c3ccc([Si](C)(C)C)cn3)c3ccc(-n4c5ccc(C(F)(F)F)cc5c5cc(C(F)(F)F)ccc54)cc23)nc1.
What is the InChIKey of [6-[2,6-bis[3,6-bis(trifluoromethyl)carbazol-9-yl]-10-(5-trimethylsilyl-2-pyridinyl)anthracen-9-yl]-3-pyridinyl]-trimethylsilane;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(5-tert-butyl-2-pyridinyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole?
The InChIKey is HPAGBCVIEGAWGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H42F12N4.C58H42F12N4Si2/c1-55(2,3)35-7-17-47(73-29-35)53-39-15-13-38(76-51-21-11-33(59(67,68)69)25-43(51)44-26-34(60(70,71)72)12-22-52(44)76)28-46(39)54(48-18-8-36(30-74-48)56(4,5)6)40-16-14-37(27-45(40)53)75-49-19-9-31(57(61,62)63)23-41(49)42-24-32(58(64,65)66)10-20-50(42)75;1-75(2,3)37-13-17-47(71-29-37)53-39-15-11-36(74-51-21-9-33(57(65,66)67)25-43(51)44-26-34(58(68,69)70)10-22-52(44)74)28-46(39)54(48-18-14-38(30-72-48)76(4,5)6)40-16-12-35(27-45(40)53)73-49-19-7-31(55(59,60)61)23-41(49)42-24-32(56(62,63)64)8-20-50(42)73/h2*7-30H,1-6H3.
What are the key properties of [6-[2,6-bis[3,6-bis(trifluoromethyl)carbazol-9-yl]-10-(5-trimethylsilyl-2-pyridinyl)anthracen-9-yl]-3-pyridinyl]-trimethylsilane;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(5-tert-butyl-2-pyridinyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole?
[6-[2,6-bis[3,6-bis(trifluoromethyl)carbazol-9-yl]-10-(5-trimethylsilyl-2-pyridinyl)anthracen-9-yl]-3-pyridinyl]-trimethylsilane;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(5-tert-butyl-2-pyridinyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole has a molecular weight of 2126.15 g/mol, XLogP of 36.46, 10 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for [6-[2,6-bis[3,6-bis(trifluoromethyl)carbazol-9-yl]-10-(5-trimethylsilyl-2-pyridinyl)anthracen-9-yl]-3-pyridinyl]-trimethylsilane;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(5-tert-butyl-2-pyridinyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole is sourced from PubChem (CID 158545175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).