4-(3-carbazol-9-ylcarbazol-9-yl)-3-[4-[2-(3-carbazol-9-ylcarbazol-9-yl)-5-cyanophenyl]-6-phenyl-1,3,5-triazin-2-yl]benzonitrile;3-[4-[5-cyano-2-[2-(3,5-dimethylphenyl)carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-4-[2-(3,5-dimethylphenyl)carbazol-9-yl]benzonitrile;4-[3-(3,5-dimethylphenyl)carbazol-9-yl]-3-[4-[2-[3-(3,5-dimethylphenyl)carbazol-9-yl]-5-isocyanophenyl]-6-phenyl-1,3,5-triazin-2-yl]benzonitrile;3-[4-[5-isocyano-2-[2-(2,4,6-trimethylphenyl)carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-4-[2-(2,4,6-trimethylphenyl)carbazol-9-yl]benzonitrile

C262H174N30 — CID 158868764

IUPAC4-(3-carbazol-9-ylcarbazol-9-yl)-3-[4-[2-(3-carbazol-9-ylcarbazol-9-yl)-5-cyanophenyl]-6-phenyl-1,3,5-triazin-2-yl]benzonitrile;3-[4-[5-cyano-2-[2-(3,5-dimethylphenyl)carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-4-[2-(3,5-dimethylphenyl)carbazol-9-yl]benzonitrile;4-[3-(3,5-dimethylphenyl)carbazol-9-yl]-3-[4-[2-[3-(3,5-dimethylphenyl)carbazol-9-yl]-5-isocyanophenyl]-6-phenyl-1,3,5-triazin-2-yl]benzonitrile;3-[4-[5-isocyano-2-[2-(2,4,6-trimethylphenyl)carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-4-[2-(2,4,6-trimethylphenyl)carbazol-9-yl]benzonitrile
SMILESCc1cc(C)cc(-c2ccc3c4ccccc4n(-c4ccc(C#N)cc4-c4nc(-c5ccccc5)nc(-c5cc(C#N)ccc5-n5c6ccccc6c6ccc(-c7cc(C)cc(C)c7)cc65)n4)c3c2)c1.N#Cc1ccc(-n2c3ccccc3c3cc(-n4c5ccccc5c5ccccc54)ccc32)c(-c2nc(-c3ccccc3)nc(-c3cc(C#N)ccc3-n3c4ccccc4c4cc(-n5c6ccccc6c6ccccc65)ccc43)n2)c1.[C-]#[N+]c1ccc(-n2c3ccccc3c3cc(-c4cc(C)cc(C)c4)ccc32)c(-c2nc(-c3ccccc3)nc(-c3cc(C#N)ccc3-n3c4ccccc4c4cc(-c5cc(C)cc(C)c5)ccc43)n2)c1.[C-]#[N+]c1ccc(-n2c3ccccc3c3ccc(-c4c(C)cc(C)cc4C)cc32)c(-c2nc(-c3ccccc3)nc(-c3cc(C#N)ccc3-n3c4ccccc4c4ccc(-c5c(C)cc(C)cc5C)cc43)n2)c1
InChIInChI=1S/C71H41N9.C65H47N7.2C63H43N7/c72-42-44-30-34-67(79-63-28-14-8-22-53(63)55-40-47(32-36-65(55)79)77-59-24-10-4-18-49(59)50-19-5-11-25-60(50)77)57(38-44)70-74-69(46-16-2-1-3-17-46)75-71(76-70)58-39-45(43-73)31-35-68(58)80-64-29-15-9-23-54(64)56-41-48(33-37-66(56)80)78-61-26-12-6-20-51(61)52-21-7-13-27-62(52)78;1-38-29-40(3)61(41(4)30-38)46-22-25-51-49-17-11-13-19-55(49)71(59(51)34-46)57-27-21-44(37-66)33-53(57)64-68-63(45-15-9-8-10-16-45)69-65(70-64)54-36-48(67-7)24-28-58(54)72-56-20-14-12-18-50(56)52-26-23-47(35-60(52)72)62-42(5)31-39(2)32-43(62)6;1-38-27-39(2)30-46(29-38)44-20-24-57-51(34-44)49-15-9-11-17-55(49)69(57)59-23-19-42(37-64)33-53(59)62-66-61(43-13-7-6-8-14-43)67-63(68-62)54-36-48(65-5)22-26-60(54)70-56-18-12-10-16-50(56)52-35-45(21-25-58(52)70)47-31-40(3)28-41(4)32-47;1-38-26-39(2)29-47(28-38)45-20-22-51-49-14-8-10-16-55(49)69(59(51)34-45)57-24-18-42(36-64)32-53(57)62-66-61(44-12-6-5-7-13-44)67-63(68-62)54-33-43(37-65)19-25-58(54)70-56-17-11-9-15-50(56)52-23-21-46(35-60(52)70)48-30-40(3)27-41(4)31-48/h1-41H;8-36H,1-6H3;6-36H,1-4H3;5-35H,1-4H3
InChIKeyJBOQIQLWXGNEHQ-UHFFFAOYSA-N
MW3742.48 g/mol
LogP65.11
Rot. Bonds28

About 4-(3-carbazol-9-ylcarbazol-9-yl)-3-[4-[2-(3-carbazol-9-ylcarbazol-9-yl)-5-cyanophenyl]-6-phenyl-1,3,5-triazin-2-yl]benzonitrile;3-[4-[5-cyano-2-[2-(3,5-dimethylphenyl)carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-4-[2-(3,5-dimethylphenyl)carbazol-9-yl]benzonitrile;4-[3-(3,5-dimethylphenyl)carbazol-9-yl]-3-[4-[2-[3-(3,5-dimethylphenyl)carbazol-9-yl]-5-isocyanophenyl]-6-phenyl-1,3,5-triazin-2-yl]benzonitrile;3-[4-[5-isocyano-2-[2-(2,4,6-trimethylphenyl)carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-4-[2-(2,4,6-trimethylphenyl)carbazol-9-yl]benzonitrile

4-(3-carbazol-9-ylcarbazol-9-yl)-3-[4-[2-(3-carbazol-9-ylcarbazol-9-yl)-5-cyanophenyl]-6-phenyl-1,3,5-triazin-2-yl]benzonitrile;3-[4-[5-cyano-2-[2-(3,5-dimethylphenyl)carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-4-[2-(3,5-dimethylphenyl)carbazol-9-yl]benzonitrile;4-[3-(3,5-dimethylphenyl)carbazol-9-yl]-3-[4-[2-[3-(3,5-dimethylphenyl)carbazol-9-yl]-5-isocyanophenyl]-6-phenyl-1,3,5-triazin-2-yl]benzonitrile;3-[4-[5-isocyano-2-[2-(2,4,6-trimethylphenyl)carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-4-[2-(2,4,6-trimethylphenyl)carbazol-9-yl]benzonitrile (PubChem CID 158868764) has the molecular formula C262H174N30 and a molecular weight of 3742.48 g/mol. Its IUPAC name is 4-(3-carbazol-9-ylcarbazol-9-yl)-3-[4-[2-(3-carbazol-9-ylcarbazol-9-yl)-5-cyanophenyl]-6-phenyl-1,3,5-triazin-2-yl]benzonitrile;3-[4-[5-cyano-2-[2-(3,5-dimethylphenyl)carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-4-[2-(3,5-dimethylphenyl)carbazol-9-yl]benzonitrile;4-[3-(3,5-dimethylphenyl)carbazol-9-yl]-3-[4-[2-[3-(3,5-dimethylphenyl)carbazol-9-yl]-5-isocyanophenyl]-6-phenyl-1,3,5-triazin-2-yl]benzonitrile;3-[4-[5-isocyano-2-[2-(2,4,6-trimethylphenyl)carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-4-[2-(2,4,6-trimethylphenyl)carbazol-9-yl]benzonitrile.

Molecular Properties

Compound Name4-(3-carbazol-9-ylcarbazol-9-yl)-3-[4-[2-(3-carbazol-9-ylcarbazol-9-yl)-5-cyanophenyl]-6-phenyl-1,3,5-triazin-2-yl]benzonitrile;3-[4-[5-cyano-2-[2-(3,5-dimethylphenyl)carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-4-[2-(3,5-dimethylphenyl)carbazol-9-yl]benzonitrile;4-[3-(3,5-dimethylphenyl)carbazol-9-yl]-3-[4-[2-[3-(3,5-dimethylphenyl)carbazol-9-yl]-5-isocyanophenyl]-6-phenyl-1,3,5-triazin-2-yl]benzonitrile;3-[4-[5-isocyano-2-[2-(2,4,6-trimethylphenyl)carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-4-[2-(2,4,6-trimethylphenyl)carbazol-9-yl]benzonitrile
PubChem CID158868764
Molecular FormulaC262H174N30
Molecular Weight3742.48 g/mol
Exact Mass3739.45
IUPAC Name4-(3-carbazol-9-ylcarbazol-9-yl)-3-[4-[2-(3-carbazol-9-ylcarbazol-9-yl)-5-cyanophenyl]-6-phenyl-1,3,5-triazin-2-yl]benzonitrile;3-[4-[5-cyano-2-[2-(3,5-dimethylphenyl)carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-4-[2-(3,5-dimethylphenyl)carbazol-9-yl]benzonitrile;4-[3-(3,5-dimethylphenyl)carbazol-9-yl]-3-[4-[2-[3-(3,5-dimethylphenyl)carbazol-9-yl]-5-isocyanophenyl]-6-phenyl-1,3,5-triazin-2-yl]benzonitrile;3-[4-[5-isocyano-2-[2-(2,4,6-trimethylphenyl)carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-4-[2-(2,4,6-trimethylphenyl)carbazol-9-yl]benzonitrile
SMILESCc1cc(C)cc(-c2ccc3c4ccccc4n(-c4ccc(C#N)cc4-c4nc(-c5ccccc5)nc(-c5cc(C#N)ccc5-n5c6ccccc6c6ccc(-c7cc(C)cc(C)c7)cc65)n4)c3c2)c1.N#Cc1ccc(-n2c3ccccc3c3cc(-n4c5ccccc5c5ccccc54)ccc32)c(-c2nc(-c3ccccc3)nc(-c3cc(C#N)ccc3-n3c4ccccc4c4cc(-n5c6ccccc6c6ccccc65)ccc43)n2)c1.[C-]#[N+]c1ccc(-n2c3ccccc3c3cc(-c4cc(C)cc(C)c4)ccc32)c(-c2nc(-c3ccccc3)nc(-c3cc(C#N)ccc3-n3c4ccccc4c4cc(-c5cc(C)cc(C)c5)ccc43)n2)c1.[C-]#[N+]c1ccc(-n2c3ccccc3c3ccc(-c4c(C)cc(C)cc4C)cc32)c(-c2nc(-c3ccccc3)nc(-c3cc(C#N)ccc3-n3c4ccccc4c4ccc(-c5c(C)cc(C)cc5C)cc43)n2)c1
InChIInChI=1S/C71H41N9.C65H47N7.2C63H43N7/c72-42-44-30-34-67(79-63-28-14-8-22-53(63)55-40-47(32-36-65(55)79)77-59-24-10-4-18-49(59)50-19-5-11-25-60(50)77)57(38-44)70-74-69(46-16-2-1-3-17-46)75-71(76-70)58-39-45(43-73)31-35-68(58)80-64-29-15-9-23-54(64)56-41-48(33-37-66(56)80)78-61-26-12-6-20-51(61)52-21-7-13-27-62(52)78;1-38-29-40(3)61(41(4)30-38)46-22-25-51-49-17-11-13-19-55(49)71(59(51)34-46)57-27-21-44(37-66)33-53(57)64-68-63(45-15-9-8-10-16-45)69-65(70-64)54-36-48(67-7)24-28-58(54)72-56-20-14-12-18-50(56)52-26-23-47(35-60(52)72)62-42(5)31-39(2)32-43(62)6;1-38-27-39(2)30-46(29-38)44-20-24-57-51(34-44)49-15-9-11-17-55(49)69(57)59-23-19-42(37-64)33-53(59)62-66-61(43-13-7-6-8-14-43)67-63(68-62)54-36-48(65-5)22-26-60(54)70-56-18-12-10-16-50(56)52-35-45(21-25-58(52)70)47-31-40(3)28-41(4)32-47;1-38-26-39(2)29-47(28-38)45-20-22-51-49-14-8-10-16-55(49)69(59(51)34-45)57-24-18-42(36-64)32-53(57)62-66-61(44-12-6-5-7-13-44)67-63(68-62)54-33-43(37-65)19-25-58(54)70-56-17-11-9-15-50(56)52-23-21-46(35-60(52)70)48-30-40(3)27-41(4)31-48/h1-41H;8-36H,1-6H3;6-36H,1-4H3;5-35H,1-4H3
InChIKeyJBOQIQLWXGNEHQ-UHFFFAOYSA-N
XLogP65.11
TPSA355.44 Ų
H-Bond Donors
H-Bond Acceptors28
Rotatable Bonds28
Heavy Atoms292
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003742.48
LogP ≤ 565.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1028

Analyze 4-(3-carbazol-9-ylcarbazol-9-yl)-3-[4-[2-(3-carbazol-9-ylcarbazol-9-yl)-5-cyanophenyl]-6-phenyl-1,3,5-triazin-2-yl]benzonitrile;3-[4-[5-cyano-2-[2-(3,5-dimethylphenyl)carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-4-[2-(3,5-dimethylphenyl)carbazol-9-yl]benzonitrile;4-[3-(3,5-dimethylphenyl)carbazol-9-yl]-3-[4-[2-[3-(3,5-dimethylphenyl)carbazol-9-yl]-5-isocyanophenyl]-6-phenyl-1,3,5-triazin-2-yl]benzonitrile;3-[4-[5-isocyano-2-[2-(2,4,6-trimethylphenyl)carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-4-[2-(2,4,6-trimethylphenyl)carbazol-9-yl]benzonitrile with MolForge

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Related Compounds

4-[3,6-bis(3,5-dimethylphenyl)carbazol-9-yl]-3-(4,6-diphenyl-1,3,5-triazin-2-yl)benzonitrile;9-[2-(4,6-dimethyl-1,3,5-triazin-2-yl)-4-isocyanophenyl]-2,7-bis(2,4,6-trimethylphenyl)carbazole;3-(4,6-dimethyl-1,3,5-triazin-2-yl)-4-[[2-(2,4,6-trimethylphenyl)carbazol-9-yl]methyl]benzonitrile;3-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-[3-(2,4,6-trimethylphenyl)carbazol-9-yl]benzonitrile
CID 157274173
3-[4-[5-cyano-2-[3-(2,4,6-trimethylphenyl)carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-4-[3-(2,4,6-trimethylphenyl)carbazol-9-yl]benzonitrile
CID 138712816
4-[3,6-bis(3,5-dimethylphenyl)carbazol-9-yl]-3-(4,6-diphenyl-1,3,5-triazin-2-yl)benzonitrile
CID 134508097
3-[9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(9-phenylcarbazol-2-yl)phenyl]carbazol-3-yl]-5-isocyanobenzonitrile
CID 169045265
9-[4-cyano-2-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-(3-isocyanocarbazol-9-yl)phenyl]phenyl]-6-isocyanocarbazole-3-carbonitrile
CID 154603054
4-(3,6-diphenylcarbazol-9-yl)-3-[4-[2-(3,6-diphenylcarbazol-9-yl)-5-isocyanophenyl]-6-[4-(3-isocyanophenyl)phenyl]-1,3,5-triazin-2-yl]benzonitrile
CID 169287415
9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(3-isocyanocarbazol-9-yl)phenyl]phenyl]phenyl]carbazole-3-carbonitrile
CID 162500537
4-[3-[3-carbazol-9-yl-5-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazol-9-yl]-3-[2-[3-[3-carbazol-9-yl-5-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazol-9-yl]-5-isocyanophenyl]benzonitrile
CID 164744076
4-[3-(2,4-diisocyanophenyl)carbazol-9-yl]-3-(4,6-diphenyl-1,3,5-triazin-2-yl)benzonitrile
CID 140871886
9-[2-[2-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-5-isocyanophenyl]-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazole;9-[2-[2-[3,6-bis(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-9-yl]-5-isocyanophenyl]-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-3,6-bis(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;4-[3-(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-3-[2-[3-(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]benzonitrile;3-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-[2-[2-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-9-yl]-5-isocyanophenyl]-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole
CID 160737686
11-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-isocyanophenyl]carbazol-3-yl]-8,14-bis(4-phenylphenyl)-8,14-diaza-1-borapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9,11,13(21),15(20),16,18-nonaene-5,17-dicarbonitrile;11-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-isocyanophenyl]carbazol-3-yl]-8,14-bis(4-phenylphenyl)-8,14-diaza-1-borapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9,11,13(21),15(20),16,18-nonaene-5,17-dicarbonitrile
CID 158111724
5-[9-[4-cyano-2-[4-[5-cyano-2-[2-(3,5-dicyanophenyl)carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazol-2-yl]benzene-1,3-dicarbonitrile
CID 138712671

Frequently Asked Questions

What is the IUPAC name of 4-(3-carbazol-9-ylcarbazol-9-yl)-3-[4-[2-(3-carbazol-9-ylcarbazol-9-yl)-5-cyanophenyl]-6-phenyl-1,3,5-triazin-2-yl]benzonitrile;3-[4-[5-cyano-2-[2-(3,5-dimethylphenyl)carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-4-[2-(3,5-dimethylphenyl)carbazol-9-yl]benzonitrile;4-[3-(3,5-dimethylphenyl)carbazol-9-yl]-3-[4-[2-[3-(3,5-dimethylphenyl)carbazol-9-yl]-5-isocyanophenyl]-6-phenyl-1,3,5-triazin-2-yl]benzonitrile;3-[4-[5-isocyano-2-[2-(2,4,6-trimethylphenyl)carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-4-[2-(2,4,6-trimethylphenyl)carbazol-9-yl]benzonitrile?
The IUPAC name of 4-(3-carbazol-9-ylcarbazol-9-yl)-3-[4-[2-(3-carbazol-9-ylcarbazol-9-yl)-5-cyanophenyl]-6-phenyl-1,3,5-triazin-2-yl]benzonitrile;3-[4-[5-cyano-2-[2-(3,5-dimethylphenyl)carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-4-[2-(3,5-dimethylphenyl)carbazol-9-yl]benzonitrile;4-[3-(3,5-dimethylphenyl)carbazol-9-yl]-3-[4-[2-[3-(3,5-dimethylphenyl)carbazol-9-yl]-5-isocyanophenyl]-6-phenyl-1,3,5-triazin-2-yl]benzonitrile;3-[4-[5-isocyano-2-[2-(2,4,6-trimethylphenyl)carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-4-[2-(2,4,6-trimethylphenyl)carbazol-9-yl]benzonitrile (CID 158868764) is 4-(3-carbazol-9-ylcarbazol-9-yl)-3-[4-[2-(3-carbazol-9-ylcarbazol-9-yl)-5-cyanophenyl]-6-phenyl-1,3,5-triazin-2-yl]benzonitrile;3-[4-[5-cyano-2-[2-(3,5-dimethylphenyl)carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-4-[2-(3,5-dimethylphenyl)carbazol-9-yl]benzonitrile;4-[3-(3,5-dimethylphenyl)carbazol-9-yl]-3-[4-[2-[3-(3,5-dimethylphenyl)carbazol-9-yl]-5-isocyanophenyl]-6-phenyl-1,3,5-triazin-2-yl]benzonitrile;3-[4-[5-isocyano-2-[2-(2,4,6-trimethylphenyl)carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-4-[2-(2,4,6-trimethylphenyl)carbazol-9-yl]benzonitrile.
What is the SMILES notation for 4-(3-carbazol-9-ylcarbazol-9-yl)-3-[4-[2-(3-carbazol-9-ylcarbazol-9-yl)-5-cyanophenyl]-6-phenyl-1,3,5-triazin-2-yl]benzonitrile;3-[4-[5-cyano-2-[2-(3,5-dimethylphenyl)carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-4-[2-(3,5-dimethylphenyl)carbazol-9-yl]benzonitrile;4-[3-(3,5-dimethylphenyl)carbazol-9-yl]-3-[4-[2-[3-(3,5-dimethylphenyl)carbazol-9-yl]-5-isocyanophenyl]-6-phenyl-1,3,5-triazin-2-yl]benzonitrile;3-[4-[5-isocyano-2-[2-(2,4,6-trimethylphenyl)carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-4-[2-(2,4,6-trimethylphenyl)carbazol-9-yl]benzonitrile?
The canonical SMILES for 4-(3-carbazol-9-ylcarbazol-9-yl)-3-[4-[2-(3-carbazol-9-ylcarbazol-9-yl)-5-cyanophenyl]-6-phenyl-1,3,5-triazin-2-yl]benzonitrile;3-[4-[5-cyano-2-[2-(3,5-dimethylphenyl)carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-4-[2-(3,5-dimethylphenyl)carbazol-9-yl]benzonitrile;4-[3-(3,5-dimethylphenyl)carbazol-9-yl]-3-[4-[2-[3-(3,5-dimethylphenyl)carbazol-9-yl]-5-isocyanophenyl]-6-phenyl-1,3,5-triazin-2-yl]benzonitrile;3-[4-[5-isocyano-2-[2-(2,4,6-trimethylphenyl)carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-4-[2-(2,4,6-trimethylphenyl)carbazol-9-yl]benzonitrile is Cc1cc(C)cc(-c2ccc3c4ccccc4n(-c4ccc(C#N)cc4-c4nc(-c5ccccc5)nc(-c5cc(C#N)ccc5-n5c6ccccc6c6ccc(-c7cc(C)cc(C)c7)cc65)n4)c3c2)c1.N#Cc1ccc(-n2c3ccccc3c3cc(-n4c5ccccc5c5ccccc54)ccc32)c(-c2nc(-c3ccccc3)nc(-c3cc(C#N)ccc3-n3c4ccccc4c4cc(-n5c6ccccc6c6ccccc65)ccc43)n2)c1.[C-]#[N+]c1ccc(-n2c3ccccc3c3cc(-c4cc(C)cc(C)c4)ccc32)c(-c2nc(-c3ccccc3)nc(-c3cc(C#N)ccc3-n3c4ccccc4c4cc(-c5cc(C)cc(C)c5)ccc43)n2)c1.[C-]#[N+]c1ccc(-n2c3ccccc3c3ccc(-c4c(C)cc(C)cc4C)cc32)c(-c2nc(-c3ccccc3)nc(-c3cc(C#N)ccc3-n3c4ccccc4c4ccc(-c5c(C)cc(C)cc5C)cc43)n2)c1.
What is the InChIKey of 4-(3-carbazol-9-ylcarbazol-9-yl)-3-[4-[2-(3-carbazol-9-ylcarbazol-9-yl)-5-cyanophenyl]-6-phenyl-1,3,5-triazin-2-yl]benzonitrile;3-[4-[5-cyano-2-[2-(3,5-dimethylphenyl)carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-4-[2-(3,5-dimethylphenyl)carbazol-9-yl]benzonitrile;4-[3-(3,5-dimethylphenyl)carbazol-9-yl]-3-[4-[2-[3-(3,5-dimethylphenyl)carbazol-9-yl]-5-isocyanophenyl]-6-phenyl-1,3,5-triazin-2-yl]benzonitrile;3-[4-[5-isocyano-2-[2-(2,4,6-trimethylphenyl)carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-4-[2-(2,4,6-trimethylphenyl)carbazol-9-yl]benzonitrile?
The InChIKey is JBOQIQLWXGNEHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C71H41N9.C65H47N7.2C63H43N7/c72-42-44-30-34-67(79-63-28-14-8-22-53(63)55-40-47(32-36-65(55)79)77-59-24-10-4-18-49(59)50-19-5-11-25-60(50)77)57(38-44)70-74-69(46-16-2-1-3-17-46)75-71(76-70)58-39-45(43-73)31-35-68(58)80-64-29-15-9-23-54(64)56-41-48(33-37-66(56)80)78-61-26-12-6-20-51(61)52-21-7-13-27-62(52)78;1-38-29-40(3)61(41(4)30-38)46-22-25-51-49-17-11-13-19-55(49)71(59(51)34-46)57-27-21-44(37-66)33-53(57)64-68-63(45-15-9-8-10-16-45)69-65(70-64)54-36-48(67-7)24-28-58(54)72-56-20-14-12-18-50(56)52-26-23-47(35-60(52)72)62-42(5)31-39(2)32-43(62)6;1-38-27-39(2)30-46(29-38)44-20-24-57-51(34-44)49-15-9-11-17-55(49)69(57)59-23-19-42(37-64)33-53(59)62-66-61(43-13-7-6-8-14-43)67-63(68-62)54-36-48(65-5)22-26-60(54)70-56-18-12-10-16-50(56)52-35-45(21-25-58(52)70)47-31-40(3)28-41(4)32-47;1-38-26-39(2)29-47(28-38)45-20-22-51-49-14-8-10-16-55(49)69(59(51)34-45)57-24-18-42(36-64)32-53(57)62-66-61(44-12-6-5-7-13-44)67-63(68-62)54-33-43(37-65)19-25-58(54)70-56-17-11-9-15-50(56)52-23-21-46(35-60(52)70)48-30-40(3)27-41(4)31-48/h1-41H;8-36H,1-6H3;6-36H,1-4H3;5-35H,1-4H3.
What are the key properties of 4-(3-carbazol-9-ylcarbazol-9-yl)-3-[4-[2-(3-carbazol-9-ylcarbazol-9-yl)-5-cyanophenyl]-6-phenyl-1,3,5-triazin-2-yl]benzonitrile;3-[4-[5-cyano-2-[2-(3,5-dimethylphenyl)carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-4-[2-(3,5-dimethylphenyl)carbazol-9-yl]benzonitrile;4-[3-(3,5-dimethylphenyl)carbazol-9-yl]-3-[4-[2-[3-(3,5-dimethylphenyl)carbazol-9-yl]-5-isocyanophenyl]-6-phenyl-1,3,5-triazin-2-yl]benzonitrile;3-[4-[5-isocyano-2-[2-(2,4,6-trimethylphenyl)carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-4-[2-(2,4,6-trimethylphenyl)carbazol-9-yl]benzonitrile?
4-(3-carbazol-9-ylcarbazol-9-yl)-3-[4-[2-(3-carbazol-9-ylcarbazol-9-yl)-5-cyanophenyl]-6-phenyl-1,3,5-triazin-2-yl]benzonitrile;3-[4-[5-cyano-2-[2-(3,5-dimethylphenyl)carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-4-[2-(3,5-dimethylphenyl)carbazol-9-yl]benzonitrile;4-[3-(3,5-dimethylphenyl)carbazol-9-yl]-3-[4-[2-[3-(3,5-dimethylphenyl)carbazol-9-yl]-5-isocyanophenyl]-6-phenyl-1,3,5-triazin-2-yl]benzonitrile;3-[4-[5-isocyano-2-[2-(2,4,6-trimethylphenyl)carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-4-[2-(2,4,6-trimethylphenyl)carbazol-9-yl]benzonitrile has a molecular weight of 3742.48 g/mol, XLogP of 65.11, 28 rotatable bonds, 0 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-carbazol-9-ylcarbazol-9-yl)-3-[4-[2-(3-carbazol-9-ylcarbazol-9-yl)-5-cyanophenyl]-6-phenyl-1,3,5-triazin-2-yl]benzonitrile;3-[4-[5-cyano-2-[2-(3,5-dimethylphenyl)carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-4-[2-(3,5-dimethylphenyl)carbazol-9-yl]benzonitrile;4-[3-(3,5-dimethylphenyl)carbazol-9-yl]-3-[4-[2-[3-(3,5-dimethylphenyl)carbazol-9-yl]-5-isocyanophenyl]-6-phenyl-1,3,5-triazin-2-yl]benzonitrile;3-[4-[5-isocyano-2-[2-(2,4,6-trimethylphenyl)carbazol-9-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-4-[2-(2,4,6-trimethylphenyl)carbazol-9-yl]benzonitrile is sourced from PubChem (CID 158868764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).