4-[3-(2-carbazol-9-yl-5-cyanophenyl)carbazol-9-yl]-3-(3,5-difluorophenyl)benzonitrile;4-[3-[4-carbazol-9-yl-3-(2,6-diphenylpyrimidin-4-yl)phenyl]carbazol-9-yl]-3-(4,6-diphenylpyrimidin-2-yl)benzonitrile;4-[3-(2-carbazol-9-ylphenyl)carbazol-9-yl]-3-(3,5-difluorophenyl)benzonitrile;4-[3-[2-carbazol-9-yl-5-(trifluoromethyl)phenyl]carbazol-9-yl]-3-(3,5-difluorophenyl)benzonitrile

C200H116F9N17 — CID 165054565

IUPAC4-[3-(2-carbazol-9-yl-5-cyanophenyl)carbazol-9-yl]-3-(3,5-difluorophenyl)benzonitrile;4-[3-[4-carbazol-9-yl-3-(2,6-diphenylpyrimidin-4-yl)phenyl]carbazol-9-yl]-3-(4,6-diphenylpyrimidin-2-yl)benzonitrile;4-[3-(2-carbazol-9-ylphenyl)carbazol-9-yl]-3-(3,5-difluorophenyl)benzonitrile;4-[3-[2-carbazol-9-yl-5-(trifluoromethyl)phenyl]carbazol-9-yl]-3-(3,5-difluorophenyl)benzonitrile
SMILESN#Cc1ccc(-n2c3ccccc3c3cc(-c4cc(C(F)(F)F)ccc4-n4c5ccccc5c5ccccc54)ccc32)c(-c2cc(F)cc(F)c2)c1.N#Cc1ccc(-n2c3ccccc3c3cc(-c4ccc(-n5c6ccccc6c6ccccc65)c(-c5cc(-c6ccccc6)nc(-c6ccccc6)n5)c4)ccc32)c(-c2nc(-c3ccccc3)cc(-c3ccccc3)n2)c1.N#Cc1ccc(-n2c3ccccc3c3cc(-c4ccccc4-n4c5ccccc5c5ccccc54)ccc32)c(-c2cc(F)cc(F)c2)c1.N#Cc1ccc(-n2c3ccccc3c3ccccc32)c(-c2ccc3c(c2)c2ccccc2n3-c2ccc(C#N)cc2-c2cc(F)cc(F)c2)c1
InChIInChI=1S/C69H43N7.C44H24F5N3.C44H24F2N4.C43H25F2N3/c70-44-45-33-36-67(57(39-45)69-72-58(46-19-5-1-6-20-46)42-59(73-69)47-21-7-2-8-22-47)76-64-32-18-15-29-54(64)55-40-50(34-37-65(55)76)51-35-38-66(75-62-30-16-13-27-52(62)53-28-14-17-31-63(53)75)56(41-51)61-43-60(48-23-9-3-10-24-48)71-68(74-61)49-25-11-4-12-26-49;45-30-20-28(21-31(46)24-30)35-19-26(25-50)13-16-41(35)52-40-12-6-3-9-34(40)37-22-27(14-17-43(37)52)36-23-29(44(47,48)49)15-18-42(36)51-38-10-4-1-7-32(38)33-8-2-5-11-39(33)51;45-31-21-30(22-32(46)24-31)37-20-28(26-48)14-17-43(37)50-41-12-6-3-9-35(41)38-23-29(15-18-44(38)50)36-19-27(25-47)13-16-42(36)49-39-10-4-1-7-33(39)34-8-2-5-11-40(34)49;44-30-22-29(23-31(45)25-30)36-21-27(26-46)17-19-42(36)48-41-16-8-4-12-35(41)37-24-28(18-20-43(37)48)32-9-1-5-13-38(32)47-39-14-6-2-10-33(39)34-11-3-7-15-40(34)47/h1-43H;1-24H;1-24H;1-25H
InChIKeyQEWFKUSPZUJXFR-UHFFFAOYSA-N
MW2928.23 g/mol
LogP51.99
Rot. Bonds21

About 4-[3-(2-carbazol-9-yl-5-cyanophenyl)carbazol-9-yl]-3-(3,5-difluorophenyl)benzonitrile;4-[3-[4-carbazol-9-yl-3-(2,6-diphenylpyrimidin-4-yl)phenyl]carbazol-9-yl]-3-(4,6-diphenylpyrimidin-2-yl)benzonitrile;4-[3-(2-carbazol-9-ylphenyl)carbazol-9-yl]-3-(3,5-difluorophenyl)benzonitrile;4-[3-[2-carbazol-9-yl-5-(trifluoromethyl)phenyl]carbazol-9-yl]-3-(3,5-difluorophenyl)benzonitrile

4-[3-(2-carbazol-9-yl-5-cyanophenyl)carbazol-9-yl]-3-(3,5-difluorophenyl)benzonitrile;4-[3-[4-carbazol-9-yl-3-(2,6-diphenylpyrimidin-4-yl)phenyl]carbazol-9-yl]-3-(4,6-diphenylpyrimidin-2-yl)benzonitrile;4-[3-(2-carbazol-9-ylphenyl)carbazol-9-yl]-3-(3,5-difluorophenyl)benzonitrile;4-[3-[2-carbazol-9-yl-5-(trifluoromethyl)phenyl]carbazol-9-yl]-3-(3,5-difluorophenyl)benzonitrile (PubChem CID 165054565) has the molecular formula C200H116F9N17 and a molecular weight of 2928.23 g/mol. Its IUPAC name is 4-[3-(2-carbazol-9-yl-5-cyanophenyl)carbazol-9-yl]-3-(3,5-difluorophenyl)benzonitrile;4-[3-[4-carbazol-9-yl-3-(2,6-diphenylpyrimidin-4-yl)phenyl]carbazol-9-yl]-3-(4,6-diphenylpyrimidin-2-yl)benzonitrile;4-[3-(2-carbazol-9-ylphenyl)carbazol-9-yl]-3-(3,5-difluorophenyl)benzonitrile;4-[3-[2-carbazol-9-yl-5-(trifluoromethyl)phenyl]carbazol-9-yl]-3-(3,5-difluorophenyl)benzonitrile.

Molecular Properties

Compound Name4-[3-(2-carbazol-9-yl-5-cyanophenyl)carbazol-9-yl]-3-(3,5-difluorophenyl)benzonitrile;4-[3-[4-carbazol-9-yl-3-(2,6-diphenylpyrimidin-4-yl)phenyl]carbazol-9-yl]-3-(4,6-diphenylpyrimidin-2-yl)benzonitrile;4-[3-(2-carbazol-9-ylphenyl)carbazol-9-yl]-3-(3,5-difluorophenyl)benzonitrile;4-[3-[2-carbazol-9-yl-5-(trifluoromethyl)phenyl]carbazol-9-yl]-3-(3,5-difluorophenyl)benzonitrile
PubChem CID165054565
Molecular FormulaC200H116F9N17
Molecular Weight2928.23 g/mol
Exact Mass2925.95
IUPAC Name4-[3-(2-carbazol-9-yl-5-cyanophenyl)carbazol-9-yl]-3-(3,5-difluorophenyl)benzonitrile;4-[3-[4-carbazol-9-yl-3-(2,6-diphenylpyrimidin-4-yl)phenyl]carbazol-9-yl]-3-(4,6-diphenylpyrimidin-2-yl)benzonitrile;4-[3-(2-carbazol-9-ylphenyl)carbazol-9-yl]-3-(3,5-difluorophenyl)benzonitrile;4-[3-[2-carbazol-9-yl-5-(trifluoromethyl)phenyl]carbazol-9-yl]-3-(3,5-difluorophenyl)benzonitrile
SMILESN#Cc1ccc(-n2c3ccccc3c3cc(-c4cc(C(F)(F)F)ccc4-n4c5ccccc5c5ccccc54)ccc32)c(-c2cc(F)cc(F)c2)c1.N#Cc1ccc(-n2c3ccccc3c3cc(-c4ccc(-n5c6ccccc6c6ccccc65)c(-c5cc(-c6ccccc6)nc(-c6ccccc6)n5)c4)ccc32)c(-c2nc(-c3ccccc3)cc(-c3ccccc3)n2)c1.N#Cc1ccc(-n2c3ccccc3c3cc(-c4ccccc4-n4c5ccccc5c5ccccc54)ccc32)c(-c2cc(F)cc(F)c2)c1.N#Cc1ccc(-n2c3ccccc3c3ccccc32)c(-c2ccc3c(c2)c2ccccc2n3-c2ccc(C#N)cc2-c2cc(F)cc(F)c2)c1
InChIInChI=1S/C69H43N7.C44H24F5N3.C44H24F2N4.C43H25F2N3/c70-44-45-33-36-67(57(39-45)69-72-58(46-19-5-1-6-20-46)42-59(73-69)47-21-7-2-8-22-47)76-64-32-18-15-29-54(64)55-40-50(34-37-65(55)76)51-35-38-66(75-62-30-16-13-27-52(62)53-28-14-17-31-63(53)75)56(41-51)61-43-60(48-23-9-3-10-24-48)71-68(74-61)49-25-11-4-12-26-49;45-30-20-28(21-31(46)24-30)35-19-26(25-50)13-16-41(35)52-40-12-6-3-9-34(40)37-22-27(14-17-43(37)52)36-23-29(44(47,48)49)15-18-42(36)51-38-10-4-1-7-32(38)33-8-2-5-11-39(33)51;45-31-21-30(22-32(46)24-31)37-20-28(26-48)14-17-43(37)50-41-12-6-3-9-35(41)38-23-29(15-18-44(38)50)36-19-27(25-47)13-16-42(36)49-39-10-4-1-7-33(39)34-8-2-5-11-40(34)49;44-30-22-29(23-31(45)25-30)36-21-27(26-46)17-19-42(36)48-41-16-8-4-12-35(41)37-24-28(18-20-43(37)48)32-9-1-5-13-38(32)47-39-14-6-2-10-33(39)34-11-3-7-15-40(34)47/h1-43H;1-24H;1-24H;1-25H
InChIKeyQEWFKUSPZUJXFR-UHFFFAOYSA-N
XLogP51.99
TPSA209.95 Ų
H-Bond Donors
H-Bond Acceptors17
Rotatable Bonds21
Heavy Atoms226
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002928.23
LogP ≤ 551.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1017

Analyze 4-[3-(2-carbazol-9-yl-5-cyanophenyl)carbazol-9-yl]-3-(3,5-difluorophenyl)benzonitrile;4-[3-[4-carbazol-9-yl-3-(2,6-diphenylpyrimidin-4-yl)phenyl]carbazol-9-yl]-3-(4,6-diphenylpyrimidin-2-yl)benzonitrile;4-[3-(2-carbazol-9-ylphenyl)carbazol-9-yl]-3-(3,5-difluorophenyl)benzonitrile;4-[3-[2-carbazol-9-yl-5-(trifluoromethyl)phenyl]carbazol-9-yl]-3-(3,5-difluorophenyl)benzonitrile with MolForge

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Related Compounds

4-[3-(4-carbazol-9-yl-3-phenylphenyl)carbazol-9-yl]-3-(4,6-diphenylpyrimidin-2-yl)benzonitrile
CID 164744087
4-[3-[4-carbazol-9-yl-3-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazol-9-yl]-3-(4,6-diphenylpyrimidin-2-yl)benzonitrile
CID 164743992
3-[3-(3-phenylcarbazol-9-yl)-4-[4-phenyl-6-[2-(3-phenylcarbazol-9-yl)-5-(trifluoromethyl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzonitrile
CID 174171018
4-[3,6-bis[2,4-bis(trifluoromethyl)phenyl]carbazol-9-yl]-3-[6-[2-[3,6-bis[2,4-bis(trifluoromethyl)phenyl]carbazol-9-yl]-5-cyanophenyl]-2-phenylpyrimidin-4-yl]benzonitrile
CID 162572662
5-[2-[3-[4-carbazol-9-yl-3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-9-yl]-5-cyanophenyl]benzene-1,3-dicarbonitrile
CID 164743999
4-[3-(4-carbazol-9-yl-3-phenylphenyl)carbazol-9-yl]-3-(3,5-difluorophenyl)benzonitrile
CID 164743983
5-[2-[3-[2-carbazol-9-yl-5-(2,6-diphenylpyrimidin-4-yl)phenyl]carbazol-9-yl]-5-cyanophenyl]benzene-1,3-dicarbonitrile;5-[2-[3-[2-carbazol-9-yl-5-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazol-9-yl]-5-cyanophenyl]benzene-1,3-dicarbonitrile;5-[2-[3-[2-carbazol-9-yl-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-9-yl]-5-cyanophenyl]benzene-1,3-dicarbonitrile
CID 165089602
2-[3-(3-phenylcarbazol-9-yl)-4-[4-phenyl-6-[2-(3-phenylcarbazol-9-yl)-5-(trifluoromethyl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzonitrile
CID 174170989
9-[2-(2-carbazol-9-ylphenyl)-4-(2,6-diphenylpyrimidin-4-yl)phenyl]-3-(trifluoromethyl)carbazole
CID 155462877
4-[9-[2-(2,6-diphenylpyrimidin-4-yl)-4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-3-yl]benzonitrile
CID 137421307
9-[2-(2,6-diphenylpyrimidin-4-yl)-4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole-3-carbonitrile
CID 137414575
4-[3-[4-carbazol-9-yl-3-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazol-9-yl]-3-(2,6-difluorophenyl)benzonitrile
CID 164744045

Frequently Asked Questions

What is the IUPAC name of 4-[3-(2-carbazol-9-yl-5-cyanophenyl)carbazol-9-yl]-3-(3,5-difluorophenyl)benzonitrile;4-[3-[4-carbazol-9-yl-3-(2,6-diphenylpyrimidin-4-yl)phenyl]carbazol-9-yl]-3-(4,6-diphenylpyrimidin-2-yl)benzonitrile;4-[3-(2-carbazol-9-ylphenyl)carbazol-9-yl]-3-(3,5-difluorophenyl)benzonitrile;4-[3-[2-carbazol-9-yl-5-(trifluoromethyl)phenyl]carbazol-9-yl]-3-(3,5-difluorophenyl)benzonitrile?
The IUPAC name of 4-[3-(2-carbazol-9-yl-5-cyanophenyl)carbazol-9-yl]-3-(3,5-difluorophenyl)benzonitrile;4-[3-[4-carbazol-9-yl-3-(2,6-diphenylpyrimidin-4-yl)phenyl]carbazol-9-yl]-3-(4,6-diphenylpyrimidin-2-yl)benzonitrile;4-[3-(2-carbazol-9-ylphenyl)carbazol-9-yl]-3-(3,5-difluorophenyl)benzonitrile;4-[3-[2-carbazol-9-yl-5-(trifluoromethyl)phenyl]carbazol-9-yl]-3-(3,5-difluorophenyl)benzonitrile (CID 165054565) is 4-[3-(2-carbazol-9-yl-5-cyanophenyl)carbazol-9-yl]-3-(3,5-difluorophenyl)benzonitrile;4-[3-[4-carbazol-9-yl-3-(2,6-diphenylpyrimidin-4-yl)phenyl]carbazol-9-yl]-3-(4,6-diphenylpyrimidin-2-yl)benzonitrile;4-[3-(2-carbazol-9-ylphenyl)carbazol-9-yl]-3-(3,5-difluorophenyl)benzonitrile;4-[3-[2-carbazol-9-yl-5-(trifluoromethyl)phenyl]carbazol-9-yl]-3-(3,5-difluorophenyl)benzonitrile.
What is the SMILES notation for 4-[3-(2-carbazol-9-yl-5-cyanophenyl)carbazol-9-yl]-3-(3,5-difluorophenyl)benzonitrile;4-[3-[4-carbazol-9-yl-3-(2,6-diphenylpyrimidin-4-yl)phenyl]carbazol-9-yl]-3-(4,6-diphenylpyrimidin-2-yl)benzonitrile;4-[3-(2-carbazol-9-ylphenyl)carbazol-9-yl]-3-(3,5-difluorophenyl)benzonitrile;4-[3-[2-carbazol-9-yl-5-(trifluoromethyl)phenyl]carbazol-9-yl]-3-(3,5-difluorophenyl)benzonitrile?
The canonical SMILES for 4-[3-(2-carbazol-9-yl-5-cyanophenyl)carbazol-9-yl]-3-(3,5-difluorophenyl)benzonitrile;4-[3-[4-carbazol-9-yl-3-(2,6-diphenylpyrimidin-4-yl)phenyl]carbazol-9-yl]-3-(4,6-diphenylpyrimidin-2-yl)benzonitrile;4-[3-(2-carbazol-9-ylphenyl)carbazol-9-yl]-3-(3,5-difluorophenyl)benzonitrile;4-[3-[2-carbazol-9-yl-5-(trifluoromethyl)phenyl]carbazol-9-yl]-3-(3,5-difluorophenyl)benzonitrile is N#Cc1ccc(-n2c3ccccc3c3cc(-c4cc(C(F)(F)F)ccc4-n4c5ccccc5c5ccccc54)ccc32)c(-c2cc(F)cc(F)c2)c1.N#Cc1ccc(-n2c3ccccc3c3cc(-c4ccc(-n5c6ccccc6c6ccccc65)c(-c5cc(-c6ccccc6)nc(-c6ccccc6)n5)c4)ccc32)c(-c2nc(-c3ccccc3)cc(-c3ccccc3)n2)c1.N#Cc1ccc(-n2c3ccccc3c3cc(-c4ccccc4-n4c5ccccc5c5ccccc54)ccc32)c(-c2cc(F)cc(F)c2)c1.N#Cc1ccc(-n2c3ccccc3c3ccccc32)c(-c2ccc3c(c2)c2ccccc2n3-c2ccc(C#N)cc2-c2cc(F)cc(F)c2)c1.
What is the InChIKey of 4-[3-(2-carbazol-9-yl-5-cyanophenyl)carbazol-9-yl]-3-(3,5-difluorophenyl)benzonitrile;4-[3-[4-carbazol-9-yl-3-(2,6-diphenylpyrimidin-4-yl)phenyl]carbazol-9-yl]-3-(4,6-diphenylpyrimidin-2-yl)benzonitrile;4-[3-(2-carbazol-9-ylphenyl)carbazol-9-yl]-3-(3,5-difluorophenyl)benzonitrile;4-[3-[2-carbazol-9-yl-5-(trifluoromethyl)phenyl]carbazol-9-yl]-3-(3,5-difluorophenyl)benzonitrile?
The InChIKey is QEWFKUSPZUJXFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C69H43N7.C44H24F5N3.C44H24F2N4.C43H25F2N3/c70-44-45-33-36-67(57(39-45)69-72-58(46-19-5-1-6-20-46)42-59(73-69)47-21-7-2-8-22-47)76-64-32-18-15-29-54(64)55-40-50(34-37-65(55)76)51-35-38-66(75-62-30-16-13-27-52(62)53-28-14-17-31-63(53)75)56(41-51)61-43-60(48-23-9-3-10-24-48)71-68(74-61)49-25-11-4-12-26-49;45-30-20-28(21-31(46)24-30)35-19-26(25-50)13-16-41(35)52-40-12-6-3-9-34(40)37-22-27(14-17-43(37)52)36-23-29(44(47,48)49)15-18-42(36)51-38-10-4-1-7-32(38)33-8-2-5-11-39(33)51;45-31-21-30(22-32(46)24-31)37-20-28(26-48)14-17-43(37)50-41-12-6-3-9-35(41)38-23-29(15-18-44(38)50)36-19-27(25-47)13-16-42(36)49-39-10-4-1-7-33(39)34-8-2-5-11-40(34)49;44-30-22-29(23-31(45)25-30)36-21-27(26-46)17-19-42(36)48-41-16-8-4-12-35(41)37-24-28(18-20-43(37)48)32-9-1-5-13-38(32)47-39-14-6-2-10-33(39)34-11-3-7-15-40(34)47/h1-43H;1-24H;1-24H;1-25H.
What are the key properties of 4-[3-(2-carbazol-9-yl-5-cyanophenyl)carbazol-9-yl]-3-(3,5-difluorophenyl)benzonitrile;4-[3-[4-carbazol-9-yl-3-(2,6-diphenylpyrimidin-4-yl)phenyl]carbazol-9-yl]-3-(4,6-diphenylpyrimidin-2-yl)benzonitrile;4-[3-(2-carbazol-9-ylphenyl)carbazol-9-yl]-3-(3,5-difluorophenyl)benzonitrile;4-[3-[2-carbazol-9-yl-5-(trifluoromethyl)phenyl]carbazol-9-yl]-3-(3,5-difluorophenyl)benzonitrile?
4-[3-(2-carbazol-9-yl-5-cyanophenyl)carbazol-9-yl]-3-(3,5-difluorophenyl)benzonitrile;4-[3-[4-carbazol-9-yl-3-(2,6-diphenylpyrimidin-4-yl)phenyl]carbazol-9-yl]-3-(4,6-diphenylpyrimidin-2-yl)benzonitrile;4-[3-(2-carbazol-9-ylphenyl)carbazol-9-yl]-3-(3,5-difluorophenyl)benzonitrile;4-[3-[2-carbazol-9-yl-5-(trifluoromethyl)phenyl]carbazol-9-yl]-3-(3,5-difluorophenyl)benzonitrile has a molecular weight of 2928.23 g/mol, XLogP of 51.99, 21 rotatable bonds, 0 hydrogen bond donors, and 17 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(2-carbazol-9-yl-5-cyanophenyl)carbazol-9-yl]-3-(3,5-difluorophenyl)benzonitrile;4-[3-[4-carbazol-9-yl-3-(2,6-diphenylpyrimidin-4-yl)phenyl]carbazol-9-yl]-3-(4,6-diphenylpyrimidin-2-yl)benzonitrile;4-[3-(2-carbazol-9-ylphenyl)carbazol-9-yl]-3-(3,5-difluorophenyl)benzonitrile;4-[3-[2-carbazol-9-yl-5-(trifluoromethyl)phenyl]carbazol-9-yl]-3-(3,5-difluorophenyl)benzonitrile is sourced from PubChem (CID 165054565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).