3-(3-carbazol-9-ylcarbazol-9-yl)-4-[2-(3-carbazol-9-ylcarbazol-9-yl)-5-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]benzonitrile;9-[2-[4-cyano-2-(3-cyano-6-isocyanocarbazol-9-yl)phenyl]-4-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]-6-isocyanocarbazole-3-carbonitrile;9-[5-cyano-2-[2-(3-isocyanocarbazol-9-yl)-5-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]phenyl]carbazole-3-carbonitrile;3-[3,6-di(carbazol-9-yl)carbazol-9-yl]-4-[2-[3,6-di(carbazol-9-yl)carbazol-9-yl]-5-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]benzonitrile

C258H148F12N24 — CID 162068122

IUPAC3-(3-carbazol-9-ylcarbazol-9-yl)-4-[2-(3-carbazol-9-ylcarbazol-9-yl)-5-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]benzonitrile;9-[2-[4-cyano-2-(3-cyano-6-isocyanocarbazol-9-yl)phenyl]-4-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]-6-isocyanocarbazole-3-carbonitrile;9-[5-cyano-2-[2-(3-isocyanocarbazol-9-yl)-5-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]phenyl]carbazole-3-carbonitrile;3-[3,6-di(carbazol-9-yl)carbazol-9-yl]-4-[2-[3,6-di(carbazol-9-yl)carbazol-9-yl]-5-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]benzonitrile
SMILESCc1cccc(C(F)(F)F)c1-c1ccc(-n2c3ccc(-n4c5ccccc5c5ccccc54)cc3c3cc(-n4c5ccccc5c5ccccc54)ccc32)c(-c2ccc(C#N)cc2-n2c3ccc(-n4c5ccccc5c5ccccc54)cc3c3cc(-n4c5ccccc5c5ccccc54)ccc32)c1.Cc1cccc(C(F)(F)F)c1-c1ccc(-n2c3ccccc3c3cc(-n4c5ccccc5c5ccccc54)ccc32)c(-c2ccc(C#N)cc2-n2c3ccccc3c3cc(-n4c5ccccc5c5ccccc54)ccc32)c1.[C-]#[N+]c1ccc2c(c1)c1cc(C#N)ccc1n2-c1ccc(-c2c(C)cccc2C(F)(F)F)cc1-c1ccc(C#N)cc1-n1c2ccc(C#N)cc2c2cc([N+]#[C-])ccc21.[C-]#[N+]c1ccc2c(c1)c1ccccc1n2-c1ccc(-c2c(C)cccc2C(F)(F)F)cc1-c1ccc(C#N)cc1-n1c2ccccc2c2cc(C#N)ccc21
InChIInChI=1S/C93H56F3N7.C69H42F3N5.C49H24F3N7.C47H26F3N5/c1-56-19-18-28-77(93(94,95)96)92(56)58-38-44-86(102-87-45-39-59(98-78-29-10-2-20-63(78)64-21-3-11-30-79(64)98)51-73(87)74-52-60(40-46-88(74)102)99-80-31-12-4-22-65(80)66-23-5-13-32-81(66)99)72(50-58)71-43-37-57(55-97)49-91(71)103-89-47-41-61(100-82-33-14-6-24-67(82)68-25-7-15-34-83(68)100)53-75(89)76-54-62(42-48-90(76)103)101-84-35-16-8-26-69(84)70-27-9-17-36-85(70)101;1-42-15-14-22-57(69(70,71)72)68(42)44-30-34-64(76-62-27-12-6-20-51(62)55-39-45(31-35-65(55)76)74-58-23-8-2-16-47(58)48-17-3-9-24-59(48)74)54(38-44)53-33-29-43(41-73)37-67(53)77-63-28-13-7-21-52(63)56-40-46(32-36-66(56)77)75-60-25-10-4-18-49(60)50-19-5-11-26-61(50)75;1-28-5-4-6-41(49(50,51)52)48(28)32-10-16-44(58-42-14-8-29(25-53)19-36(42)39-23-33(56-2)11-17-45(39)58)38(22-32)35-13-7-31(27-55)21-47(35)59-43-15-9-30(26-54)20-37(43)40-24-34(57-3)12-18-46(40)59;1-28-8-7-11-39(47(48,49)50)46(28)31-16-20-43(54-40-12-5-4-10-34(40)38-25-32(53-2)17-21-44(38)54)37(24-31)35-18-14-30(27-52)23-45(35)55-41-13-6-3-9-33(41)36-22-29(26-51)15-19-42(36)55/h2-54H,1H3;2-40H,1H3;4-24H,1H3;3-25H,1H3
InChIKeyZASJKOYWYCDVNG-UHFFFAOYSA-N
MW3812.17 g/mol
LogP69.50
Rot. Bonds22

About 3-(3-carbazol-9-ylcarbazol-9-yl)-4-[2-(3-carbazol-9-ylcarbazol-9-yl)-5-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]benzonitrile;9-[2-[4-cyano-2-(3-cyano-6-isocyanocarbazol-9-yl)phenyl]-4-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]-6-isocyanocarbazole-3-carbonitrile;9-[5-cyano-2-[2-(3-isocyanocarbazol-9-yl)-5-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]phenyl]carbazole-3-carbonitrile;3-[3,6-di(carbazol-9-yl)carbazol-9-yl]-4-[2-[3,6-di(carbazol-9-yl)carbazol-9-yl]-5-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]benzonitrile

3-(3-carbazol-9-ylcarbazol-9-yl)-4-[2-(3-carbazol-9-ylcarbazol-9-yl)-5-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]benzonitrile;9-[2-[4-cyano-2-(3-cyano-6-isocyanocarbazol-9-yl)phenyl]-4-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]-6-isocyanocarbazole-3-carbonitrile;9-[5-cyano-2-[2-(3-isocyanocarbazol-9-yl)-5-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]phenyl]carbazole-3-carbonitrile;3-[3,6-di(carbazol-9-yl)carbazol-9-yl]-4-[2-[3,6-di(carbazol-9-yl)carbazol-9-yl]-5-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]benzonitrile (PubChem CID 162068122) has the molecular formula C258H148F12N24 and a molecular weight of 3812.17 g/mol. Its IUPAC name is 3-(3-carbazol-9-ylcarbazol-9-yl)-4-[2-(3-carbazol-9-ylcarbazol-9-yl)-5-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]benzonitrile;9-[2-[4-cyano-2-(3-cyano-6-isocyanocarbazol-9-yl)phenyl]-4-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]-6-isocyanocarbazole-3-carbonitrile;9-[5-cyano-2-[2-(3-isocyanocarbazol-9-yl)-5-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]phenyl]carbazole-3-carbonitrile;3-[3,6-di(carbazol-9-yl)carbazol-9-yl]-4-[2-[3,6-di(carbazol-9-yl)carbazol-9-yl]-5-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]benzonitrile.

Molecular Properties

Compound Name3-(3-carbazol-9-ylcarbazol-9-yl)-4-[2-(3-carbazol-9-ylcarbazol-9-yl)-5-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]benzonitrile;9-[2-[4-cyano-2-(3-cyano-6-isocyanocarbazol-9-yl)phenyl]-4-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]-6-isocyanocarbazole-3-carbonitrile;9-[5-cyano-2-[2-(3-isocyanocarbazol-9-yl)-5-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]phenyl]carbazole-3-carbonitrile;3-[3,6-di(carbazol-9-yl)carbazol-9-yl]-4-[2-[3,6-di(carbazol-9-yl)carbazol-9-yl]-5-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]benzonitrile
PubChem CID162068122
Molecular FormulaC258H148F12N24
Molecular Weight3812.17 g/mol
Exact Mass3809.21
IUPAC Name3-(3-carbazol-9-ylcarbazol-9-yl)-4-[2-(3-carbazol-9-ylcarbazol-9-yl)-5-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]benzonitrile;9-[2-[4-cyano-2-(3-cyano-6-isocyanocarbazol-9-yl)phenyl]-4-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]-6-isocyanocarbazole-3-carbonitrile;9-[5-cyano-2-[2-(3-isocyanocarbazol-9-yl)-5-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]phenyl]carbazole-3-carbonitrile;3-[3,6-di(carbazol-9-yl)carbazol-9-yl]-4-[2-[3,6-di(carbazol-9-yl)carbazol-9-yl]-5-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]benzonitrile
SMILESCc1cccc(C(F)(F)F)c1-c1ccc(-n2c3ccc(-n4c5ccccc5c5ccccc54)cc3c3cc(-n4c5ccccc5c5ccccc54)ccc32)c(-c2ccc(C#N)cc2-n2c3ccc(-n4c5ccccc5c5ccccc54)cc3c3cc(-n4c5ccccc5c5ccccc54)ccc32)c1.Cc1cccc(C(F)(F)F)c1-c1ccc(-n2c3ccccc3c3cc(-n4c5ccccc5c5ccccc54)ccc32)c(-c2ccc(C#N)cc2-n2c3ccccc3c3cc(-n4c5ccccc5c5ccccc54)ccc32)c1.[C-]#[N+]c1ccc2c(c1)c1cc(C#N)ccc1n2-c1ccc(-c2c(C)cccc2C(F)(F)F)cc1-c1ccc(C#N)cc1-n1c2ccc(C#N)cc2c2cc([N+]#[C-])ccc21.[C-]#[N+]c1ccc2c(c1)c1ccccc1n2-c1ccc(-c2c(C)cccc2C(F)(F)F)cc1-c1ccc(C#N)cc1-n1c2ccccc2c2cc(C#N)ccc21
InChIInChI=1S/C93H56F3N7.C69H42F3N5.C49H24F3N7.C47H26F3N5/c1-56-19-18-28-77(93(94,95)96)92(56)58-38-44-86(102-87-45-39-59(98-78-29-10-2-20-63(78)64-21-3-11-30-79(64)98)51-73(87)74-52-60(40-46-88(74)102)99-80-31-12-4-22-65(80)66-23-5-13-32-81(66)99)72(50-58)71-43-37-57(55-97)49-91(71)103-89-47-41-61(100-82-33-14-6-24-67(82)68-25-7-15-34-83(68)100)53-75(89)76-54-62(42-48-90(76)103)101-84-35-16-8-26-69(84)70-27-9-17-36-85(70)101;1-42-15-14-22-57(69(70,71)72)68(42)44-30-34-64(76-62-27-12-6-20-51(62)55-39-45(31-35-65(55)76)74-58-23-8-2-16-47(58)48-17-3-9-24-59(48)74)54(38-44)53-33-29-43(41-73)37-67(53)77-63-28-13-7-21-52(63)56-40-46(32-36-66(56)77)75-60-25-10-4-18-49(60)50-19-5-11-26-61(50)75;1-28-5-4-6-41(49(50,51)52)48(28)32-10-16-44(58-42-14-8-29(25-53)19-36(42)39-23-33(56-2)11-17-45(39)58)38(22-32)35-13-7-31(27-55)21-47(35)59-43-15-9-30(26-54)20-37(43)40-24-34(57-3)12-18-46(40)59;1-28-8-7-11-39(47(48,49)50)46(28)31-16-20-43(54-40-12-5-4-10-34(40)38-25-32(53-2)17-21-44(38)54)37(24-31)35-18-14-30(27-52)23-45(35)55-41-13-6-3-9-33(41)36-22-29(26-51)15-19-42(36)55/h2-54H,1H3;2-40H,1H3;4-24H,1H3;3-25H,1H3
InChIKeyZASJKOYWYCDVNG-UHFFFAOYSA-N
XLogP69.50
TPSA248.63 Ų
H-Bond Donors
H-Bond Acceptors21
Rotatable Bonds22
Heavy Atoms294
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003812.17
LogP ≤ 569.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1021

Analyze 3-(3-carbazol-9-ylcarbazol-9-yl)-4-[2-(3-carbazol-9-ylcarbazol-9-yl)-5-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]benzonitrile;9-[2-[4-cyano-2-(3-cyano-6-isocyanocarbazol-9-yl)phenyl]-4-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]-6-isocyanocarbazole-3-carbonitrile;9-[5-cyano-2-[2-(3-isocyanocarbazol-9-yl)-5-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]phenyl]carbazole-3-carbonitrile;3-[3,6-di(carbazol-9-yl)carbazol-9-yl]-4-[2-[3,6-di(carbazol-9-yl)carbazol-9-yl]-5-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]benzonitrile with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(3-carbazol-9-ylcarbazol-9-yl)-3-[2-(3-carbazol-9-ylcarbazol-9-yl)-5-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]benzonitrile
CID 161215511
4-[5-[2,6-bis(trifluoromethyl)phenyl]-2-[3,6-di(carbazol-9-yl)carbazol-9-yl]phenyl]-3-[3,6-di(carbazol-9-yl)carbazol-9-yl]benzonitrile
CID 138499420
3-[4-[2,6-bis(trifluoromethyl)phenyl]-2-[3,6-di(carbazol-9-yl)carbazol-9-yl]phenyl]-4-[3,6-di(carbazol-9-yl)carbazol-9-yl]benzonitrile
CID 138499755
9-[4-[2,6-bis(trifluoromethyl)phenyl]-2-[4-cyano-2-(3-cyanocarbazol-9-yl)phenyl]phenyl]carbazole-3-carbonitrile
CID 138499425
4-[3-(3-cyano-5-isocyanophenyl)carbazol-9-yl]-3-[5-[3-(3-cyano-5-isocyanophenyl)carbazol-9-yl]-2-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]benzonitrile
CID 159091556
2-[9-[2-[2-[3-(2-cyanophenyl)carbazol-9-yl]-4-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]-4-isocyanophenyl]carbazol-3-yl]benzonitrile
CID 159432219
9-[2-[2-[3,6-bis(2-methylphenyl)carbazol-9-yl]-4-isocyanophenyl]-5-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]-3,6-bis(2-methylphenyl)carbazole;9-[2-[2-[3,6-bis(3-methylphenyl)carbazol-9-yl]-4-isocyanophenyl]-5-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]-3,6-bis(3-methylphenyl)carbazole;9-[2-[2-[3,6-bis(4-methylphenyl)carbazol-9-yl]-4-isocyanophenyl]-5-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]-3,6-bis(4-methylphenyl)carbazole;3-[3-(2-methylphenyl)carbazol-9-yl]-4-[2-[3-(2-methylphenyl)carbazol-9-yl]-4-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]benzonitrile;3-[3-(3-methylphenyl)carbazol-9-yl]-4-[2-[3-(3-methylphenyl)carbazol-9-yl]-4-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]benzonitrile;3-[3-(4-methylphenyl)carbazol-9-yl]-4-[2-[3-(4-methylphenyl)carbazol-9-yl]-4-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]benzonitrile
CID 161437882
3-[3-(2-methylphenyl)carbazol-9-yl]-4-[2-[3-(2-methylphenyl)carbazol-9-yl]-4-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]benzonitrile
CID 161437884
5-[9-[2-[2-[3-(3,5-diisocyanophenyl)carbazol-9-yl]-5-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]-4-isocyanophenyl]carbazol-3-yl]benzene-1,3-dicarbonitrile
CID 158282073
3-[3-(3-methylphenyl)carbazol-9-yl]-4-[2-[3-(3-methylphenyl)carbazol-9-yl]-4-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]benzonitrile
CID 161437885
4-[4-[2,6-bis(trifluoromethyl)phenyl]-2-[3-(2-methylphenyl)carbazol-9-yl]phenyl]-3-[3-(2-methylphenyl)carbazol-9-yl]benzonitrile
CID 138499564
2-[3-(2-cyano-4-isocyanophenyl)carbazol-9-yl]-6-[3-(4-cyano-2-isocyanophenyl)carbazol-9-yl]-4-[2-methyl-6-(trifluoromethyl)phenyl]benzonitrile
CID 157257853

Frequently Asked Questions

What is the IUPAC name of 3-(3-carbazol-9-ylcarbazol-9-yl)-4-[2-(3-carbazol-9-ylcarbazol-9-yl)-5-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]benzonitrile;9-[2-[4-cyano-2-(3-cyano-6-isocyanocarbazol-9-yl)phenyl]-4-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]-6-isocyanocarbazole-3-carbonitrile;9-[5-cyano-2-[2-(3-isocyanocarbazol-9-yl)-5-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]phenyl]carbazole-3-carbonitrile;3-[3,6-di(carbazol-9-yl)carbazol-9-yl]-4-[2-[3,6-di(carbazol-9-yl)carbazol-9-yl]-5-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]benzonitrile?
The IUPAC name of 3-(3-carbazol-9-ylcarbazol-9-yl)-4-[2-(3-carbazol-9-ylcarbazol-9-yl)-5-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]benzonitrile;9-[2-[4-cyano-2-(3-cyano-6-isocyanocarbazol-9-yl)phenyl]-4-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]-6-isocyanocarbazole-3-carbonitrile;9-[5-cyano-2-[2-(3-isocyanocarbazol-9-yl)-5-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]phenyl]carbazole-3-carbonitrile;3-[3,6-di(carbazol-9-yl)carbazol-9-yl]-4-[2-[3,6-di(carbazol-9-yl)carbazol-9-yl]-5-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]benzonitrile (CID 162068122) is 3-(3-carbazol-9-ylcarbazol-9-yl)-4-[2-(3-carbazol-9-ylcarbazol-9-yl)-5-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]benzonitrile;9-[2-[4-cyano-2-(3-cyano-6-isocyanocarbazol-9-yl)phenyl]-4-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]-6-isocyanocarbazole-3-carbonitrile;9-[5-cyano-2-[2-(3-isocyanocarbazol-9-yl)-5-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]phenyl]carbazole-3-carbonitrile;3-[3,6-di(carbazol-9-yl)carbazol-9-yl]-4-[2-[3,6-di(carbazol-9-yl)carbazol-9-yl]-5-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]benzonitrile.
What is the SMILES notation for 3-(3-carbazol-9-ylcarbazol-9-yl)-4-[2-(3-carbazol-9-ylcarbazol-9-yl)-5-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]benzonitrile;9-[2-[4-cyano-2-(3-cyano-6-isocyanocarbazol-9-yl)phenyl]-4-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]-6-isocyanocarbazole-3-carbonitrile;9-[5-cyano-2-[2-(3-isocyanocarbazol-9-yl)-5-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]phenyl]carbazole-3-carbonitrile;3-[3,6-di(carbazol-9-yl)carbazol-9-yl]-4-[2-[3,6-di(carbazol-9-yl)carbazol-9-yl]-5-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]benzonitrile?
The canonical SMILES for 3-(3-carbazol-9-ylcarbazol-9-yl)-4-[2-(3-carbazol-9-ylcarbazol-9-yl)-5-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]benzonitrile;9-[2-[4-cyano-2-(3-cyano-6-isocyanocarbazol-9-yl)phenyl]-4-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]-6-isocyanocarbazole-3-carbonitrile;9-[5-cyano-2-[2-(3-isocyanocarbazol-9-yl)-5-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]phenyl]carbazole-3-carbonitrile;3-[3,6-di(carbazol-9-yl)carbazol-9-yl]-4-[2-[3,6-di(carbazol-9-yl)carbazol-9-yl]-5-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]benzonitrile is Cc1cccc(C(F)(F)F)c1-c1ccc(-n2c3ccc(-n4c5ccccc5c5ccccc54)cc3c3cc(-n4c5ccccc5c5ccccc54)ccc32)c(-c2ccc(C#N)cc2-n2c3ccc(-n4c5ccccc5c5ccccc54)cc3c3cc(-n4c5ccccc5c5ccccc54)ccc32)c1.Cc1cccc(C(F)(F)F)c1-c1ccc(-n2c3ccccc3c3cc(-n4c5ccccc5c5ccccc54)ccc32)c(-c2ccc(C#N)cc2-n2c3ccccc3c3cc(-n4c5ccccc5c5ccccc54)ccc32)c1.[C-]#[N+]c1ccc2c(c1)c1cc(C#N)ccc1n2-c1ccc(-c2c(C)cccc2C(F)(F)F)cc1-c1ccc(C#N)cc1-n1c2ccc(C#N)cc2c2cc([N+]#[C-])ccc21.[C-]#[N+]c1ccc2c(c1)c1ccccc1n2-c1ccc(-c2c(C)cccc2C(F)(F)F)cc1-c1ccc(C#N)cc1-n1c2ccccc2c2cc(C#N)ccc21.
What is the InChIKey of 3-(3-carbazol-9-ylcarbazol-9-yl)-4-[2-(3-carbazol-9-ylcarbazol-9-yl)-5-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]benzonitrile;9-[2-[4-cyano-2-(3-cyano-6-isocyanocarbazol-9-yl)phenyl]-4-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]-6-isocyanocarbazole-3-carbonitrile;9-[5-cyano-2-[2-(3-isocyanocarbazol-9-yl)-5-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]phenyl]carbazole-3-carbonitrile;3-[3,6-di(carbazol-9-yl)carbazol-9-yl]-4-[2-[3,6-di(carbazol-9-yl)carbazol-9-yl]-5-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]benzonitrile?
The InChIKey is ZASJKOYWYCDVNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C93H56F3N7.C69H42F3N5.C49H24F3N7.C47H26F3N5/c1-56-19-18-28-77(93(94,95)96)92(56)58-38-44-86(102-87-45-39-59(98-78-29-10-2-20-63(78)64-21-3-11-30-79(64)98)51-73(87)74-52-60(40-46-88(74)102)99-80-31-12-4-22-65(80)66-23-5-13-32-81(66)99)72(50-58)71-43-37-57(55-97)49-91(71)103-89-47-41-61(100-82-33-14-6-24-67(82)68-25-7-15-34-83(68)100)53-75(89)76-54-62(42-48-90(76)103)101-84-35-16-8-26-69(84)70-27-9-17-36-85(70)101;1-42-15-14-22-57(69(70,71)72)68(42)44-30-34-64(76-62-27-12-6-20-51(62)55-39-45(31-35-65(55)76)74-58-23-8-2-16-47(58)48-17-3-9-24-59(48)74)54(38-44)53-33-29-43(41-73)37-67(53)77-63-28-13-7-21-52(63)56-40-46(32-36-66(56)77)75-60-25-10-4-18-49(60)50-19-5-11-26-61(50)75;1-28-5-4-6-41(49(50,51)52)48(28)32-10-16-44(58-42-14-8-29(25-53)19-36(42)39-23-33(56-2)11-17-45(39)58)38(22-32)35-13-7-31(27-55)21-47(35)59-43-15-9-30(26-54)20-37(43)40-24-34(57-3)12-18-46(40)59;1-28-8-7-11-39(47(48,49)50)46(28)31-16-20-43(54-40-12-5-4-10-34(40)38-25-32(53-2)17-21-44(38)54)37(24-31)35-18-14-30(27-52)23-45(35)55-41-13-6-3-9-33(41)36-22-29(26-51)15-19-42(36)55/h2-54H,1H3;2-40H,1H3;4-24H,1H3;3-25H,1H3.
What are the key properties of 3-(3-carbazol-9-ylcarbazol-9-yl)-4-[2-(3-carbazol-9-ylcarbazol-9-yl)-5-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]benzonitrile;9-[2-[4-cyano-2-(3-cyano-6-isocyanocarbazol-9-yl)phenyl]-4-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]-6-isocyanocarbazole-3-carbonitrile;9-[5-cyano-2-[2-(3-isocyanocarbazol-9-yl)-5-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]phenyl]carbazole-3-carbonitrile;3-[3,6-di(carbazol-9-yl)carbazol-9-yl]-4-[2-[3,6-di(carbazol-9-yl)carbazol-9-yl]-5-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]benzonitrile?
3-(3-carbazol-9-ylcarbazol-9-yl)-4-[2-(3-carbazol-9-ylcarbazol-9-yl)-5-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]benzonitrile;9-[2-[4-cyano-2-(3-cyano-6-isocyanocarbazol-9-yl)phenyl]-4-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]-6-isocyanocarbazole-3-carbonitrile;9-[5-cyano-2-[2-(3-isocyanocarbazol-9-yl)-5-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]phenyl]carbazole-3-carbonitrile;3-[3,6-di(carbazol-9-yl)carbazol-9-yl]-4-[2-[3,6-di(carbazol-9-yl)carbazol-9-yl]-5-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]benzonitrile has a molecular weight of 3812.17 g/mol, XLogP of 69.50, 22 rotatable bonds, 0 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-carbazol-9-ylcarbazol-9-yl)-4-[2-(3-carbazol-9-ylcarbazol-9-yl)-5-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]benzonitrile;9-[2-[4-cyano-2-(3-cyano-6-isocyanocarbazol-9-yl)phenyl]-4-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]-6-isocyanocarbazole-3-carbonitrile;9-[5-cyano-2-[2-(3-isocyanocarbazol-9-yl)-5-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]phenyl]carbazole-3-carbonitrile;3-[3,6-di(carbazol-9-yl)carbazol-9-yl]-4-[2-[3,6-di(carbazol-9-yl)carbazol-9-yl]-5-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]benzonitrile is sourced from PubChem (CID 162068122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).