9-[4-[2,7-bis(6-phenyl-3-pyridinyl)carbazol-9-yl]-2-(3,5-difluorophenyl)-5-(trifluoromethyl)phenyl]-2,7-bis(6-phenyl-3-pyridinyl)carbazole;9-[4-[3,6-bis(6-phenyl-3-pyridinyl)carbazol-9-yl]-2-(3,5-difluorophenyl)-5-(trifluoromethyl)phenyl]-3,6-bis(6-phenyl-3-pyridinyl)carbazole;9-[2-(3,5-difluorophenyl)-4-[2-(2-phenyl-4-pyridinyl)carbazol-9-yl]-5-(trifluoromethyl)phenyl]-2-(2-phenyl-4-pyridinyl)carbazole

C221H133F15N16 — CID 157367263

IUPAC9-[4-[2,7-bis(6-phenyl-3-pyridinyl)carbazol-9-yl]-2-(3,5-difluorophenyl)-5-(trifluoromethyl)phenyl]-2,7-bis(6-phenyl-3-pyridinyl)carbazole;9-[4-[3,6-bis(6-phenyl-3-pyridinyl)carbazol-9-yl]-2-(3,5-difluorophenyl)-5-(trifluoromethyl)phenyl]-3,6-bis(6-phenyl-3-pyridinyl)carbazole;9-[2-(3,5-difluorophenyl)-4-[2-(2-phenyl-4-pyridinyl)carbazol-9-yl]-5-(trifluoromethyl)phenyl]-2-(2-phenyl-4-pyridinyl)carbazole
SMILESFc1cc(F)cc(-c2cc(-n3c4cc(-c5ccc(-c6ccccc6)nc5)ccc4c4ccc(-c5ccc(-c6ccccc6)nc5)cc43)c(C(F)(F)F)cc2-n2c3cc(-c4ccc(-c5ccccc5)nc4)ccc3c3ccc(-c4ccc(-c5ccccc5)nc4)cc32)c1.Fc1cc(F)cc(-c2cc(-n3c4ccc(-c5ccc(-c6ccccc6)nc5)cc4c4cc(-c5ccc(-c6ccccc6)nc5)ccc43)c(C(F)(F)F)cc2-n2c3ccc(-c4ccc(-c5ccccc5)nc4)cc3c3cc(-c4ccc(-c5ccccc5)nc4)ccc32)c1.Fc1cc(F)cc(-c2cc(-n3c4ccccc4c4ccc(-c5ccnc(-c6ccccc6)c5)cc43)c(C(F)(F)F)cc2-n2c3ccccc3c3ccc(-c4ccnc(-c5ccccc5)c4)cc32)c1
InChIInChI=1S/2C81H49F5N6.C59H35F5N4/c82-63-37-62(38-64(83)43-63)65-44-80(92-77-35-27-56(60-23-31-73(89-48-60)52-17-9-3-10-18-52)41-68(77)69-42-57(28-36-78(69)92)61-24-32-74(90-49-61)53-19-11-4-12-20-53)70(81(84,85)86)45-79(65)91-75-33-25-54(58-21-29-71(87-46-58)50-13-5-1-6-14-50)39-66(75)67-40-55(26-34-76(67)91)59-22-30-72(88-47-59)51-15-7-2-8-16-51;82-63-37-62(38-64(83)43-63)69-44-80(92-77-41-56(60-27-35-73(89-48-60)52-17-9-3-10-18-52)23-31-67(77)68-32-24-57(42-78(68)92)61-28-36-74(90-49-61)53-19-11-4-12-20-53)70(81(84,85)86)45-79(69)91-75-39-54(58-25-33-71(87-46-58)50-13-5-1-6-14-50)21-29-65(75)66-30-22-55(40-76(66)91)59-26-34-72(88-47-59)51-15-7-2-8-16-51;60-43-27-42(28-44(61)33-43)49-34-58(68-54-18-10-8-16-46(54)48-22-20-39(32-56(48)68)41-24-26-66-52(30-41)37-13-5-2-6-14-37)50(59(62,63)64)35-57(49)67-53-17-9-7-15-45(53)47-21-19-38(31-55(47)67)40-23-25-65-51(29-40)36-11-3-1-4-12-36/h2*1-49H;1-35H
InChIKeyBJIIAKQQVCHCEJ-UHFFFAOYSA-N
MW3297.58 g/mol
LogP59.82
Rot. Bonds29

About 9-[4-[2,7-bis(6-phenyl-3-pyridinyl)carbazol-9-yl]-2-(3,5-difluorophenyl)-5-(trifluoromethyl)phenyl]-2,7-bis(6-phenyl-3-pyridinyl)carbazole;9-[4-[3,6-bis(6-phenyl-3-pyridinyl)carbazol-9-yl]-2-(3,5-difluorophenyl)-5-(trifluoromethyl)phenyl]-3,6-bis(6-phenyl-3-pyridinyl)carbazole;9-[2-(3,5-difluorophenyl)-4-[2-(2-phenyl-4-pyridinyl)carbazol-9-yl]-5-(trifluoromethyl)phenyl]-2-(2-phenyl-4-pyridinyl)carbazole

9-[4-[2,7-bis(6-phenyl-3-pyridinyl)carbazol-9-yl]-2-(3,5-difluorophenyl)-5-(trifluoromethyl)phenyl]-2,7-bis(6-phenyl-3-pyridinyl)carbazole;9-[4-[3,6-bis(6-phenyl-3-pyridinyl)carbazol-9-yl]-2-(3,5-difluorophenyl)-5-(trifluoromethyl)phenyl]-3,6-bis(6-phenyl-3-pyridinyl)carbazole;9-[2-(3,5-difluorophenyl)-4-[2-(2-phenyl-4-pyridinyl)carbazol-9-yl]-5-(trifluoromethyl)phenyl]-2-(2-phenyl-4-pyridinyl)carbazole (PubChem CID 157367263) has the molecular formula C221H133F15N16 and a molecular weight of 3297.58 g/mol. Its IUPAC name is 9-[4-[2,7-bis(6-phenyl-3-pyridinyl)carbazol-9-yl]-2-(3,5-difluorophenyl)-5-(trifluoromethyl)phenyl]-2,7-bis(6-phenyl-3-pyridinyl)carbazole;9-[4-[3,6-bis(6-phenyl-3-pyridinyl)carbazol-9-yl]-2-(3,5-difluorophenyl)-5-(trifluoromethyl)phenyl]-3,6-bis(6-phenyl-3-pyridinyl)carbazole;9-[2-(3,5-difluorophenyl)-4-[2-(2-phenyl-4-pyridinyl)carbazol-9-yl]-5-(trifluoromethyl)phenyl]-2-(2-phenyl-4-pyridinyl)carbazole.

Molecular Properties

Compound Name9-[4-[2,7-bis(6-phenyl-3-pyridinyl)carbazol-9-yl]-2-(3,5-difluorophenyl)-5-(trifluoromethyl)phenyl]-2,7-bis(6-phenyl-3-pyridinyl)carbazole;9-[4-[3,6-bis(6-phenyl-3-pyridinyl)carbazol-9-yl]-2-(3,5-difluorophenyl)-5-(trifluoromethyl)phenyl]-3,6-bis(6-phenyl-3-pyridinyl)carbazole;9-[2-(3,5-difluorophenyl)-4-[2-(2-phenyl-4-pyridinyl)carbazol-9-yl]-5-(trifluoromethyl)phenyl]-2-(2-phenyl-4-pyridinyl)carbazole
PubChem CID157367263
Molecular FormulaC221H133F15N16
Molecular Weight3297.58 g/mol
Exact Mass3295.07
IUPAC Name9-[4-[2,7-bis(6-phenyl-3-pyridinyl)carbazol-9-yl]-2-(3,5-difluorophenyl)-5-(trifluoromethyl)phenyl]-2,7-bis(6-phenyl-3-pyridinyl)carbazole;9-[4-[3,6-bis(6-phenyl-3-pyridinyl)carbazol-9-yl]-2-(3,5-difluorophenyl)-5-(trifluoromethyl)phenyl]-3,6-bis(6-phenyl-3-pyridinyl)carbazole;9-[2-(3,5-difluorophenyl)-4-[2-(2-phenyl-4-pyridinyl)carbazol-9-yl]-5-(trifluoromethyl)phenyl]-2-(2-phenyl-4-pyridinyl)carbazole
SMILESFc1cc(F)cc(-c2cc(-n3c4cc(-c5ccc(-c6ccccc6)nc5)ccc4c4ccc(-c5ccc(-c6ccccc6)nc5)cc43)c(C(F)(F)F)cc2-n2c3cc(-c4ccc(-c5ccccc5)nc4)ccc3c3ccc(-c4ccc(-c5ccccc5)nc4)cc32)c1.Fc1cc(F)cc(-c2cc(-n3c4ccc(-c5ccc(-c6ccccc6)nc5)cc4c4cc(-c5ccc(-c6ccccc6)nc5)ccc43)c(C(F)(F)F)cc2-n2c3ccc(-c4ccc(-c5ccccc5)nc4)cc3c3cc(-c4ccc(-c5ccccc5)nc4)ccc32)c1.Fc1cc(F)cc(-c2cc(-n3c4ccccc4c4ccc(-c5ccnc(-c6ccccc6)c5)cc43)c(C(F)(F)F)cc2-n2c3ccccc3c3ccc(-c4ccnc(-c5ccccc5)c4)cc32)c1
InChIInChI=1S/2C81H49F5N6.C59H35F5N4/c82-63-37-62(38-64(83)43-63)65-44-80(92-77-35-27-56(60-23-31-73(89-48-60)52-17-9-3-10-18-52)41-68(77)69-42-57(28-36-78(69)92)61-24-32-74(90-49-61)53-19-11-4-12-20-53)70(81(84,85)86)45-79(65)91-75-33-25-54(58-21-29-71(87-46-58)50-13-5-1-6-14-50)39-66(75)67-40-55(26-34-76(67)91)59-22-30-72(88-47-59)51-15-7-2-8-16-51;82-63-37-62(38-64(83)43-63)69-44-80(92-77-41-56(60-27-35-73(89-48-60)52-17-9-3-10-18-52)23-31-67(77)68-32-24-57(42-78(68)92)61-28-36-74(90-49-61)53-19-11-4-12-20-53)70(81(84,85)86)45-79(69)91-75-39-54(58-25-33-71(87-46-58)50-13-5-1-6-14-50)21-29-65(75)66-30-22-55(40-76(66)91)59-26-34-72(88-47-59)51-15-7-2-8-16-51;60-43-27-42(28-44(61)33-43)49-34-58(68-54-18-10-8-16-46(54)48-22-20-39(32-56(48)68)41-24-26-66-52(30-41)37-13-5-2-6-14-37)50(59(62,63)64)35-57(49)67-53-17-9-7-15-45(53)47-21-19-38(31-55(47)67)40-23-25-65-51(29-40)36-11-3-1-4-12-36/h2*1-49H;1-35H
InChIKeyBJIIAKQQVCHCEJ-UHFFFAOYSA-N
XLogP59.82
TPSA158.48 Ų
H-Bond Donors
H-Bond Acceptors16
Rotatable Bonds29
Heavy Atoms252
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003297.58
LogP ≤ 559.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1016

Analyze 9-[4-[2,7-bis(6-phenyl-3-pyridinyl)carbazol-9-yl]-2-(3,5-difluorophenyl)-5-(trifluoromethyl)phenyl]-2,7-bis(6-phenyl-3-pyridinyl)carbazole;9-[4-[3,6-bis(6-phenyl-3-pyridinyl)carbazol-9-yl]-2-(3,5-difluorophenyl)-5-(trifluoromethyl)phenyl]-3,6-bis(6-phenyl-3-pyridinyl)carbazole;9-[2-(3,5-difluorophenyl)-4-[2-(2-phenyl-4-pyridinyl)carbazol-9-yl]-5-(trifluoromethyl)phenyl]-2-(2-phenyl-4-pyridinyl)carbazole with MolForge

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 9-[4-[2,7-bis(6-phenyl-3-pyridinyl)carbazol-9-yl]-2-(3,5-difluorophenyl)-5-(trifluoromethyl)phenyl]-2,7-bis(6-phenyl-3-pyridinyl)carbazole;9-[4-[3,6-bis(6-phenyl-3-pyridinyl)carbazol-9-yl]-2-(3,5-difluorophenyl)-5-(trifluoromethyl)phenyl]-3,6-bis(6-phenyl-3-pyridinyl)carbazole;9-[2-(3,5-difluorophenyl)-4-[2-(2-phenyl-4-pyridinyl)carbazol-9-yl]-5-(trifluoromethyl)phenyl]-2-(2-phenyl-4-pyridinyl)carbazole?
The IUPAC name of 9-[4-[2,7-bis(6-phenyl-3-pyridinyl)carbazol-9-yl]-2-(3,5-difluorophenyl)-5-(trifluoromethyl)phenyl]-2,7-bis(6-phenyl-3-pyridinyl)carbazole;9-[4-[3,6-bis(6-phenyl-3-pyridinyl)carbazol-9-yl]-2-(3,5-difluorophenyl)-5-(trifluoromethyl)phenyl]-3,6-bis(6-phenyl-3-pyridinyl)carbazole;9-[2-(3,5-difluorophenyl)-4-[2-(2-phenyl-4-pyridinyl)carbazol-9-yl]-5-(trifluoromethyl)phenyl]-2-(2-phenyl-4-pyridinyl)carbazole (CID 157367263) is 9-[4-[2,7-bis(6-phenyl-3-pyridinyl)carbazol-9-yl]-2-(3,5-difluorophenyl)-5-(trifluoromethyl)phenyl]-2,7-bis(6-phenyl-3-pyridinyl)carbazole;9-[4-[3,6-bis(6-phenyl-3-pyridinyl)carbazol-9-yl]-2-(3,5-difluorophenyl)-5-(trifluoromethyl)phenyl]-3,6-bis(6-phenyl-3-pyridinyl)carbazole;9-[2-(3,5-difluorophenyl)-4-[2-(2-phenyl-4-pyridinyl)carbazol-9-yl]-5-(trifluoromethyl)phenyl]-2-(2-phenyl-4-pyridinyl)carbazole.
What is the SMILES notation for 9-[4-[2,7-bis(6-phenyl-3-pyridinyl)carbazol-9-yl]-2-(3,5-difluorophenyl)-5-(trifluoromethyl)phenyl]-2,7-bis(6-phenyl-3-pyridinyl)carbazole;9-[4-[3,6-bis(6-phenyl-3-pyridinyl)carbazol-9-yl]-2-(3,5-difluorophenyl)-5-(trifluoromethyl)phenyl]-3,6-bis(6-phenyl-3-pyridinyl)carbazole;9-[2-(3,5-difluorophenyl)-4-[2-(2-phenyl-4-pyridinyl)carbazol-9-yl]-5-(trifluoromethyl)phenyl]-2-(2-phenyl-4-pyridinyl)carbazole?
The canonical SMILES for 9-[4-[2,7-bis(6-phenyl-3-pyridinyl)carbazol-9-yl]-2-(3,5-difluorophenyl)-5-(trifluoromethyl)phenyl]-2,7-bis(6-phenyl-3-pyridinyl)carbazole;9-[4-[3,6-bis(6-phenyl-3-pyridinyl)carbazol-9-yl]-2-(3,5-difluorophenyl)-5-(trifluoromethyl)phenyl]-3,6-bis(6-phenyl-3-pyridinyl)carbazole;9-[2-(3,5-difluorophenyl)-4-[2-(2-phenyl-4-pyridinyl)carbazol-9-yl]-5-(trifluoromethyl)phenyl]-2-(2-phenyl-4-pyridinyl)carbazole is Fc1cc(F)cc(-c2cc(-n3c4cc(-c5ccc(-c6ccccc6)nc5)ccc4c4ccc(-c5ccc(-c6ccccc6)nc5)cc43)c(C(F)(F)F)cc2-n2c3cc(-c4ccc(-c5ccccc5)nc4)ccc3c3ccc(-c4ccc(-c5ccccc5)nc4)cc32)c1.Fc1cc(F)cc(-c2cc(-n3c4ccc(-c5ccc(-c6ccccc6)nc5)cc4c4cc(-c5ccc(-c6ccccc6)nc5)ccc43)c(C(F)(F)F)cc2-n2c3ccc(-c4ccc(-c5ccccc5)nc4)cc3c3cc(-c4ccc(-c5ccccc5)nc4)ccc32)c1.Fc1cc(F)cc(-c2cc(-n3c4ccccc4c4ccc(-c5ccnc(-c6ccccc6)c5)cc43)c(C(F)(F)F)cc2-n2c3ccccc3c3ccc(-c4ccnc(-c5ccccc5)c4)cc32)c1.
What is the InChIKey of 9-[4-[2,7-bis(6-phenyl-3-pyridinyl)carbazol-9-yl]-2-(3,5-difluorophenyl)-5-(trifluoromethyl)phenyl]-2,7-bis(6-phenyl-3-pyridinyl)carbazole;9-[4-[3,6-bis(6-phenyl-3-pyridinyl)carbazol-9-yl]-2-(3,5-difluorophenyl)-5-(trifluoromethyl)phenyl]-3,6-bis(6-phenyl-3-pyridinyl)carbazole;9-[2-(3,5-difluorophenyl)-4-[2-(2-phenyl-4-pyridinyl)carbazol-9-yl]-5-(trifluoromethyl)phenyl]-2-(2-phenyl-4-pyridinyl)carbazole?
The InChIKey is BJIIAKQQVCHCEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C81H49F5N6.C59H35F5N4/c82-63-37-62(38-64(83)43-63)65-44-80(92-77-35-27-56(60-23-31-73(89-48-60)52-17-9-3-10-18-52)41-68(77)69-42-57(28-36-78(69)92)61-24-32-74(90-49-61)53-19-11-4-12-20-53)70(81(84,85)86)45-79(65)91-75-33-25-54(58-21-29-71(87-46-58)50-13-5-1-6-14-50)39-66(75)67-40-55(26-34-76(67)91)59-22-30-72(88-47-59)51-15-7-2-8-16-51;82-63-37-62(38-64(83)43-63)69-44-80(92-77-41-56(60-27-35-73(89-48-60)52-17-9-3-10-18-52)23-31-67(77)68-32-24-57(42-78(68)92)61-28-36-74(90-49-61)53-19-11-4-12-20-53)70(81(84,85)86)45-79(69)91-75-39-54(58-25-33-71(87-46-58)50-13-5-1-6-14-50)21-29-65(75)66-30-22-55(40-76(66)91)59-26-34-72(88-47-59)51-15-7-2-8-16-51;60-43-27-42(28-44(61)33-43)49-34-58(68-54-18-10-8-16-46(54)48-22-20-39(32-56(48)68)41-24-26-66-52(30-41)37-13-5-2-6-14-37)50(59(62,63)64)35-57(49)67-53-17-9-7-15-45(53)47-21-19-38(31-55(47)67)40-23-25-65-51(29-40)36-11-3-1-4-12-36/h2*1-49H;1-35H.
What are the key properties of 9-[4-[2,7-bis(6-phenyl-3-pyridinyl)carbazol-9-yl]-2-(3,5-difluorophenyl)-5-(trifluoromethyl)phenyl]-2,7-bis(6-phenyl-3-pyridinyl)carbazole;9-[4-[3,6-bis(6-phenyl-3-pyridinyl)carbazol-9-yl]-2-(3,5-difluorophenyl)-5-(trifluoromethyl)phenyl]-3,6-bis(6-phenyl-3-pyridinyl)carbazole;9-[2-(3,5-difluorophenyl)-4-[2-(2-phenyl-4-pyridinyl)carbazol-9-yl]-5-(trifluoromethyl)phenyl]-2-(2-phenyl-4-pyridinyl)carbazole?
9-[4-[2,7-bis(6-phenyl-3-pyridinyl)carbazol-9-yl]-2-(3,5-difluorophenyl)-5-(trifluoromethyl)phenyl]-2,7-bis(6-phenyl-3-pyridinyl)carbazole;9-[4-[3,6-bis(6-phenyl-3-pyridinyl)carbazol-9-yl]-2-(3,5-difluorophenyl)-5-(trifluoromethyl)phenyl]-3,6-bis(6-phenyl-3-pyridinyl)carbazole;9-[2-(3,5-difluorophenyl)-4-[2-(2-phenyl-4-pyridinyl)carbazol-9-yl]-5-(trifluoromethyl)phenyl]-2-(2-phenyl-4-pyridinyl)carbazole has a molecular weight of 3297.58 g/mol, XLogP of 59.82, 29 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[4-[2,7-bis(6-phenyl-3-pyridinyl)carbazol-9-yl]-2-(3,5-difluorophenyl)-5-(trifluoromethyl)phenyl]-2,7-bis(6-phenyl-3-pyridinyl)carbazole;9-[4-[3,6-bis(6-phenyl-3-pyridinyl)carbazol-9-yl]-2-(3,5-difluorophenyl)-5-(trifluoromethyl)phenyl]-3,6-bis(6-phenyl-3-pyridinyl)carbazole;9-[2-(3,5-difluorophenyl)-4-[2-(2-phenyl-4-pyridinyl)carbazol-9-yl]-5-(trifluoromethyl)phenyl]-2-(2-phenyl-4-pyridinyl)carbazole is sourced from PubChem (CID 157367263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).