9-[5-cyano-2-(3-cyanocarbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole-3-carbonitrile;9-[5-cyano-2-[6-cyano-2-[(Z)-prop-1-enyl]indol-1-yl]-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole-2-carbonitrile;9-[2-(3-cyano-6-isocyanocarbazol-9-yl)-4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole-3,6-dicarbonitrile;9-[2-(2,7-diisocyanocarbazol-9-yl)-5-isocyano-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-7-isocyanocarbazole-2-carbonitrile;9-[2-(2,7-diphenylcarbazol-9-yl)-4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-2,7-diphenylcarbazole;9-[2-(3,6-diphenylcarbazol-9-yl)-4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-3,6-diphenylcarbazole;9-[4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]-2-(3-phenylcarbazol-9-yl)phenyl]-3-phenylcarbazole;2-[3-methyl-5-(trifluoromethyl)phenyl]-4,5-bis(2-phenylcarbazol-9-yl)benzonitrile

C395H230F24N36 — CID 159905857

IUPAC9-[5-cyano-2-(3-cyanocarbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole-3-carbonitrile;9-[5-cyano-2-[6-cyano-2-[(Z)-prop-1-enyl]indol-1-yl]-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole-2-carbonitrile;9-[2-(3-cyano-6-isocyanocarbazol-9-yl)-4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole-3,6-dicarbonitrile;9-[2-(2,7-diisocyanocarbazol-9-yl)-5-isocyano-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-7-isocyanocarbazole-2-carbonitrile;9-[2-(2,7-diphenylcarbazol-9-yl)-4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-2,7-diphenylcarbazole;9-[2-(3,6-diphenylcarbazol-9-yl)-4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-3,6-diphenylcarbazole;9-[4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]-2-(3-phenylcarbazol-9-yl)phenyl]-3-phenylcarbazole;2-[3-methyl-5-(trifluoromethyl)phenyl]-4,5-bis(2-phenylcarbazol-9-yl)benzonitrile
SMILESC/C=C\c1cc2ccc(C#N)cc2n1-c1cc(-c2cc(C)cc(C(F)(F)F)c2)c(C#N)cc1-n1c2ccccc2c2ccc(C#N)cc21.Cc1cc(-c2cc(-n3c4ccccc4c4cc(C#N)ccc43)c(-n3c4ccccc4c4cc(C#N)ccc43)cc2C#N)cc(C(F)(F)F)c1.Cc1cc(-c2cc(-n3c4ccccc4c4ccc(-c5ccccc5)cc43)c(-n3c4ccccc4c4ccc(-c5ccccc5)cc43)cc2C#N)cc(C(F)(F)F)c1.[C-]#[N+]c1cc(-n2c3cc(-c4ccccc4)ccc3c3ccc(-c4ccccc4)cc32)c(-n2c3cc(-c4ccccc4)ccc3c3ccc(-c4ccccc4)cc32)cc1-c1cc(C)cc(C(F)(F)F)c1.[C-]#[N+]c1cc(-n2c3ccc(-c4ccccc4)cc3c3cc(-c4ccccc4)ccc32)c(-n2c3ccc(-c4ccccc4)cc3c3cc(-c4ccccc4)ccc32)cc1-c1cc(C)cc(C(F)(F)F)c1.[C-]#[N+]c1cc(-n2c3ccccc3c3cc(-c4ccccc4)ccc32)c(-n2c3ccccc3c3cc(-c4ccccc4)ccc32)cc1-c1cc(C)cc(C(F)(F)F)c1.[C-]#[N+]c1ccc2c(c1)c1cc(C#N)ccc1n2-c1cc([N+]#[C-])c(-c2cc(C)cc(C(F)(F)F)c2)cc1-n1c2ccc(C#N)cc2c2cc(C#N)ccc21.[C-]#[N+]c1ccc2c3ccc(C#N)cc3n(-c3cc([N+]#[C-])c(-c4cc(C)cc(C(F)(F)F)c4)cc3-n3c4cc([N+]#[C-])ccc4c4ccc([N+]#[C-])cc43)c2c1
InChIInChI=1S/2C63H40F3N3.2C51H32F3N3.2C43H20F3N7.C41H22F3N5.C40H24F3N5/c1-40-31-49(33-50(32-40)63(64,65)66)51-38-61(68-57-27-23-45(41-15-7-3-8-16-41)34-52(57)53-35-46(24-28-58(53)68)42-17-9-4-10-18-42)62(39-56(51)67-2)69-59-29-25-47(43-19-11-5-12-20-43)36-54(59)55-37-48(26-30-60(55)69)44-21-13-6-14-22-44;1-40-31-49(33-50(32-40)63(64,65)66)55-38-61(68-57-34-45(41-15-7-3-8-16-41)23-27-51(57)52-28-24-46(35-58(52)68)42-17-9-4-10-18-42)62(39-56(55)67-2)69-59-36-47(43-19-11-5-12-20-43)25-29-53(59)54-30-26-48(37-60(54)69)44-21-13-6-14-22-44;1-32-25-37(27-38(26-32)51(52,53)54)41-30-49(56-45-19-11-9-17-39(45)42-28-35(21-23-47(42)56)33-13-5-3-6-14-33)50(31-44(41)55-2)57-46-20-12-10-18-40(46)43-29-36(22-24-48(43)57)34-15-7-4-8-16-34;1-32-24-37(26-39(25-32)51(52,53)54)44-30-50(57-46-19-11-9-17-41(46)43-23-21-36(28-48(43)57)34-14-6-3-7-15-34)49(29-38(44)31-55)56-45-18-10-8-16-40(45)42-22-20-35(27-47(42)56)33-12-4-2-5-13-33;1-24-14-26(17-27(15-24)43(44,45)46)35-21-41(53-39-19-29(49-3)8-12-33(39)34-13-9-30(50-4)20-40(34)53)42(22-36(35)51-5)52-37-16-25(23-47)6-10-31(37)32-11-7-28(48-2)18-38(32)52;1-24-12-28(17-29(13-24)43(44,45)46)31-19-41(52-37-8-4-25(21-47)14-32(37)33-15-26(22-48)5-9-38(33)52)42(20-36(31)51-3)53-39-10-6-27(23-49)16-34(39)35-18-30(50-2)7-11-40(35)53;1-24-14-27(18-29(15-24)41(42,43)44)32-20-40(49-36-9-5-3-7-31(36)34-17-26(22-46)11-13-38(34)49)39(19-28(32)23-47)48-35-8-4-2-6-30(35)33-16-25(21-45)10-12-37(33)48;1-3-6-31-18-27-11-9-25(21-44)15-36(27)47(31)39-20-34(28-13-24(2)14-30(17-28)40(41,42)43)29(23-46)19-38(39)48-35-8-5-4-7-32(35)33-12-10-26(22-45)16-37(33)48/h2*3-39H,1H3;3-31H,1H3;2-30H,1H3;6-22H,1H3;4-20H,1H3;2-20H,1H3;3-20H,1-2H3/b;;;;;;;6-3-
InChIKeyNWOFVYXZFXQZCV-OMDYRWHESA-N
MW5936.39 g/mol
LogP110.43
Rot. Bonds37

About 9-[5-cyano-2-(3-cyanocarbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole-3-carbonitrile;9-[5-cyano-2-[6-cyano-2-[(Z)-prop-1-enyl]indol-1-yl]-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole-2-carbonitrile;9-[2-(3-cyano-6-isocyanocarbazol-9-yl)-4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole-3,6-dicarbonitrile;9-[2-(2,7-diisocyanocarbazol-9-yl)-5-isocyano-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-7-isocyanocarbazole-2-carbonitrile;9-[2-(2,7-diphenylcarbazol-9-yl)-4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-2,7-diphenylcarbazole;9-[2-(3,6-diphenylcarbazol-9-yl)-4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-3,6-diphenylcarbazole;9-[4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]-2-(3-phenylcarbazol-9-yl)phenyl]-3-phenylcarbazole;2-[3-methyl-5-(trifluoromethyl)phenyl]-4,5-bis(2-phenylcarbazol-9-yl)benzonitrile

9-[5-cyano-2-(3-cyanocarbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole-3-carbonitrile;9-[5-cyano-2-[6-cyano-2-[(Z)-prop-1-enyl]indol-1-yl]-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole-2-carbonitrile;9-[2-(3-cyano-6-isocyanocarbazol-9-yl)-4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole-3,6-dicarbonitrile;9-[2-(2,7-diisocyanocarbazol-9-yl)-5-isocyano-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-7-isocyanocarbazole-2-carbonitrile;9-[2-(2,7-diphenylcarbazol-9-yl)-4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-2,7-diphenylcarbazole;9-[2-(3,6-diphenylcarbazol-9-yl)-4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-3,6-diphenylcarbazole;9-[4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]-2-(3-phenylcarbazol-9-yl)phenyl]-3-phenylcarbazole;2-[3-methyl-5-(trifluoromethyl)phenyl]-4,5-bis(2-phenylcarbazol-9-yl)benzonitrile (PubChem CID 159905857) has the molecular formula C395H230F24N36 and a molecular weight of 5936.39 g/mol. Its IUPAC name is 9-[5-cyano-2-(3-cyanocarbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole-3-carbonitrile;9-[5-cyano-2-[6-cyano-2-[(Z)-prop-1-enyl]indol-1-yl]-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole-2-carbonitrile;9-[2-(3-cyano-6-isocyanocarbazol-9-yl)-4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole-3,6-dicarbonitrile;9-[2-(2,7-diisocyanocarbazol-9-yl)-5-isocyano-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-7-isocyanocarbazole-2-carbonitrile;9-[2-(2,7-diphenylcarbazol-9-yl)-4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-2,7-diphenylcarbazole;9-[2-(3,6-diphenylcarbazol-9-yl)-4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-3,6-diphenylcarbazole;9-[4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]-2-(3-phenylcarbazol-9-yl)phenyl]-3-phenylcarbazole;2-[3-methyl-5-(trifluoromethyl)phenyl]-4,5-bis(2-phenylcarbazol-9-yl)benzonitrile.

Molecular Properties

Compound Name9-[5-cyano-2-(3-cyanocarbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole-3-carbonitrile;9-[5-cyano-2-[6-cyano-2-[(Z)-prop-1-enyl]indol-1-yl]-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole-2-carbonitrile;9-[2-(3-cyano-6-isocyanocarbazol-9-yl)-4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole-3,6-dicarbonitrile;9-[2-(2,7-diisocyanocarbazol-9-yl)-5-isocyano-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-7-isocyanocarbazole-2-carbonitrile;9-[2-(2,7-diphenylcarbazol-9-yl)-4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-2,7-diphenylcarbazole;9-[2-(3,6-diphenylcarbazol-9-yl)-4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-3,6-diphenylcarbazole;9-[4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]-2-(3-phenylcarbazol-9-yl)phenyl]-3-phenylcarbazole;2-[3-methyl-5-(trifluoromethyl)phenyl]-4,5-bis(2-phenylcarbazol-9-yl)benzonitrile
PubChem CID159905857
Molecular FormulaC395H230F24N36
Molecular Weight5936.39 g/mol
Exact Mass5931.87
IUPAC Name9-[5-cyano-2-(3-cyanocarbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole-3-carbonitrile;9-[5-cyano-2-[6-cyano-2-[(Z)-prop-1-enyl]indol-1-yl]-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole-2-carbonitrile;9-[2-(3-cyano-6-isocyanocarbazol-9-yl)-4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole-3,6-dicarbonitrile;9-[2-(2,7-diisocyanocarbazol-9-yl)-5-isocyano-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-7-isocyanocarbazole-2-carbonitrile;9-[2-(2,7-diphenylcarbazol-9-yl)-4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-2,7-diphenylcarbazole;9-[2-(3,6-diphenylcarbazol-9-yl)-4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-3,6-diphenylcarbazole;9-[4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]-2-(3-phenylcarbazol-9-yl)phenyl]-3-phenylcarbazole;2-[3-methyl-5-(trifluoromethyl)phenyl]-4,5-bis(2-phenylcarbazol-9-yl)benzonitrile
SMILESC/C=C\c1cc2ccc(C#N)cc2n1-c1cc(-c2cc(C)cc(C(F)(F)F)c2)c(C#N)cc1-n1c2ccccc2c2ccc(C#N)cc21.Cc1cc(-c2cc(-n3c4ccccc4c4cc(C#N)ccc43)c(-n3c4ccccc4c4cc(C#N)ccc43)cc2C#N)cc(C(F)(F)F)c1.Cc1cc(-c2cc(-n3c4ccccc4c4ccc(-c5ccccc5)cc43)c(-n3c4ccccc4c4ccc(-c5ccccc5)cc43)cc2C#N)cc(C(F)(F)F)c1.[C-]#[N+]c1cc(-n2c3cc(-c4ccccc4)ccc3c3ccc(-c4ccccc4)cc32)c(-n2c3cc(-c4ccccc4)ccc3c3ccc(-c4ccccc4)cc32)cc1-c1cc(C)cc(C(F)(F)F)c1.[C-]#[N+]c1cc(-n2c3ccc(-c4ccccc4)cc3c3cc(-c4ccccc4)ccc32)c(-n2c3ccc(-c4ccccc4)cc3c3cc(-c4ccccc4)ccc32)cc1-c1cc(C)cc(C(F)(F)F)c1.[C-]#[N+]c1cc(-n2c3ccccc3c3cc(-c4ccccc4)ccc32)c(-n2c3ccccc3c3cc(-c4ccccc4)ccc32)cc1-c1cc(C)cc(C(F)(F)F)c1.[C-]#[N+]c1ccc2c(c1)c1cc(C#N)ccc1n2-c1cc([N+]#[C-])c(-c2cc(C)cc(C(F)(F)F)c2)cc1-n1c2ccc(C#N)cc2c2cc(C#N)ccc21.[C-]#[N+]c1ccc2c3ccc(C#N)cc3n(-c3cc([N+]#[C-])c(-c4cc(C)cc(C(F)(F)F)c4)cc3-n3c4cc([N+]#[C-])ccc4c4ccc([N+]#[C-])cc43)c2c1
InChIInChI=1S/2C63H40F3N3.2C51H32F3N3.2C43H20F3N7.C41H22F3N5.C40H24F3N5/c1-40-31-49(33-50(32-40)63(64,65)66)51-38-61(68-57-27-23-45(41-15-7-3-8-16-41)34-52(57)53-35-46(24-28-58(53)68)42-17-9-4-10-18-42)62(39-56(51)67-2)69-59-29-25-47(43-19-11-5-12-20-43)36-54(59)55-37-48(26-30-60(55)69)44-21-13-6-14-22-44;1-40-31-49(33-50(32-40)63(64,65)66)55-38-61(68-57-34-45(41-15-7-3-8-16-41)23-27-51(57)52-28-24-46(35-58(52)68)42-17-9-4-10-18-42)62(39-56(55)67-2)69-59-36-47(43-19-11-5-12-20-43)25-29-53(59)54-30-26-48(37-60(54)69)44-21-13-6-14-22-44;1-32-25-37(27-38(26-32)51(52,53)54)41-30-49(56-45-19-11-9-17-39(45)42-28-35(21-23-47(42)56)33-13-5-3-6-14-33)50(31-44(41)55-2)57-46-20-12-10-18-40(46)43-29-36(22-24-48(43)57)34-15-7-4-8-16-34;1-32-24-37(26-39(25-32)51(52,53)54)44-30-50(57-46-19-11-9-17-41(46)43-23-21-36(28-48(43)57)34-14-6-3-7-15-34)49(29-38(44)31-55)56-45-18-10-8-16-40(45)42-22-20-35(27-47(42)56)33-12-4-2-5-13-33;1-24-14-26(17-27(15-24)43(44,45)46)35-21-41(53-39-19-29(49-3)8-12-33(39)34-13-9-30(50-4)20-40(34)53)42(22-36(35)51-5)52-37-16-25(23-47)6-10-31(37)32-11-7-28(48-2)18-38(32)52;1-24-12-28(17-29(13-24)43(44,45)46)31-19-41(52-37-8-4-25(21-47)14-32(37)33-15-26(22-48)5-9-38(33)52)42(20-36(31)51-3)53-39-10-6-27(23-49)16-34(39)35-18-30(50-2)7-11-40(35)53;1-24-14-27(18-29(15-24)41(42,43)44)32-20-40(49-36-9-5-3-7-31(36)34-17-26(22-46)11-13-38(34)49)39(19-28(32)23-47)48-35-8-4-2-6-30(35)33-16-25(21-45)10-12-37(33)48;1-3-6-31-18-27-11-9-25(21-44)15-36(27)47(31)39-20-34(28-13-24(2)14-30(17-28)40(41,42)43)29(23-46)19-38(39)48-35-8-5-4-7-32(35)33-12-10-26(22-45)16-37(33)48/h2*3-39H,1H3;3-31H,1H3;2-30H,1H3;6-22H,1H3;4-20H,1H3;2-20H,1H3;3-20H,1-2H3/b;;;;;;;6-3-
InChIKeyNWOFVYXZFXQZCV-OMDYRWHESA-N
XLogP110.43
TPSA379.81 Ų
H-Bond Donors
H-Bond Acceptors27
Rotatable Bonds37
Heavy Atoms455
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5005936.39
LogP ≤ 5110.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1027

Analyze 9-[5-cyano-2-(3-cyanocarbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole-3-carbonitrile;9-[5-cyano-2-[6-cyano-2-[(Z)-prop-1-enyl]indol-1-yl]-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole-2-carbonitrile;9-[2-(3-cyano-6-isocyanocarbazol-9-yl)-4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole-3,6-dicarbonitrile;9-[2-(2,7-diisocyanocarbazol-9-yl)-5-isocyano-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-7-isocyanocarbazole-2-carbonitrile;9-[2-(2,7-diphenylcarbazol-9-yl)-4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-2,7-diphenylcarbazole;9-[2-(3,6-diphenylcarbazol-9-yl)-4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-3,6-diphenylcarbazole;9-[4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]-2-(3-phenylcarbazol-9-yl)phenyl]-3-phenylcarbazole;2-[3-methyl-5-(trifluoromethyl)phenyl]-4,5-bis(2-phenylcarbazol-9-yl)benzonitrile with MolForge

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Related Compounds

9-[2-[2,7-bis(trifluoromethyl)carbazol-9-yl]-4-(2,6-dimethyl-4-pyridinyl)-5-isocyanophenyl]-2-methyl-7-(trifluoromethyl)carbazole;9-[2-[3,6-bis(trifluoromethyl)carbazol-9-yl]-4-(2,6-diphenyl-4-pyridinyl)-5-isocyanophenyl]-3-methyl-6-(trifluoromethyl)carbazole;9-[2-(3-cyano-6-isocyanocarbazol-9-yl)-5-(2,6-diphenyl-4-pyridinyl)-4-isocyanophenyl]carbazole-3,6-dicarbonitrile;9-[2-(2,7-diisocyanocarbazol-9-yl)-4-(2,6-dimethyl-4-pyridinyl)-5-isocyanophenyl]-7-isocyanocarbazole-2-carbonitrile;2-(2,6-dimethyl-4-pyridinyl)-4,5-bis[2-(trifluoromethyl)carbazol-9-yl]benzonitrile;9-[4-(2,6-dimethyl-4-pyridinyl)-5-isocyano-2-[2-(2-methylphenyl)carbazol-9-yl]phenyl]-2-(2-methylphenyl)carbazole;9-[4-(2,6-diphenyl-4-pyridinyl)-5-isocyano-2-[3-(trifluoromethyl)carbazol-9-yl]phenyl]-3-(trifluoromethyl)carbazole
CID 159455042
4,5-bis[3-(3-cyanophenyl)carbazol-9-yl]-2-[3-methyl-5-(trifluoromethyl)phenyl]benzonitrile
CID 139562714
9-[5-cyano-2-(3-cyanocarbazol-9-yl)-4-[3-isocyano-5-(trifluoromethyl)phenyl]phenyl]carbazole-3-carbonitrile
CID 155654198
2-[2-(2-cyano-4-isocyanophenyl)carbazol-9-yl]-6-[2-(4-cyano-2-isocyanophenyl)carbazol-9-yl]-4-[3-methyl-5-(trifluoromethyl)phenyl]benzonitrile
CID 162228469
4-[9-[5-cyano-2-[2-[3-(2,4-diisocyanophenyl)carbazol-9-yl]-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]phenyl]carbazol-3-yl]benzene-1,3-dicarbonitrile
CID 157112803
9-[2-cyano-4-(3,6-diisocyanocarbazol-9-yl)-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole-3,6-dicarbonitrile
CID 158394056
9-[4-isocyano-2-[3-(4-methylphenyl)carbazol-9-yl]-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-3-(4-methylphenyl)carbazole
CID 162096729
3-[5-[2,7-bis(3-cyanophenyl)carbazol-9-yl]-4-[2,7-bis(3-isocyanophenyl)carbazol-9-yl]-2-isocyanophenyl]-5-methylbenzonitrile;3-[4-[3-(3-cyanophenyl)carbazol-9-yl]-2-isocyano-5-[3-(3-isocyanophenyl)carbazol-9-yl]phenyl]-5-methylbenzonitrile;3-[2-isocyano-4,5-bis[2-(3-isocyanophenyl)carbazol-9-yl]phenyl]-5-methylbenzonitrile
CID 160700322
4,5-bis[2,7-bis(2-methylphenyl)carbazol-9-yl]-2-(3-cyanophenyl)benzonitrile;3-[5-[3,6-bis(trifluoromethyl)carbazol-9-yl]-2-isocyano-4-[3-methyl-6-(trifluoromethyl)carbazol-9-yl]phenyl]benzonitrile;3-[2-isocyano-4,5-bis[2-(2-methylphenyl)carbazol-9-yl]phenyl]benzonitrile;3-[2-isocyano-4,5-bis[3-(2-methylphenyl)carbazol-9-yl]phenyl]benzonitrile
CID 159024972
2-[2-isocyano-4,5-bis[2-(4-methylphenyl)carbazol-9-yl]phenyl]-5-(trifluoromethyl)benzonitrile
CID 153302736
2-[4,5-bis[3-(4-cyanophenyl)carbazol-9-yl]-2-isocyanophenyl]-5-(trifluoromethyl)benzonitrile
CID 153302781
4,5-bis[3,6-bis(4-methylphenyl)carbazol-9-yl]-2-[3-isocyano-5-(trifluoromethyl)phenyl]benzonitrile
CID 155654234

Frequently Asked Questions

What is the IUPAC name of 9-[5-cyano-2-(3-cyanocarbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole-3-carbonitrile;9-[5-cyano-2-[6-cyano-2-[(Z)-prop-1-enyl]indol-1-yl]-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole-2-carbonitrile;9-[2-(3-cyano-6-isocyanocarbazol-9-yl)-4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole-3,6-dicarbonitrile;9-[2-(2,7-diisocyanocarbazol-9-yl)-5-isocyano-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-7-isocyanocarbazole-2-carbonitrile;9-[2-(2,7-diphenylcarbazol-9-yl)-4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-2,7-diphenylcarbazole;9-[2-(3,6-diphenylcarbazol-9-yl)-4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-3,6-diphenylcarbazole;9-[4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]-2-(3-phenylcarbazol-9-yl)phenyl]-3-phenylcarbazole;2-[3-methyl-5-(trifluoromethyl)phenyl]-4,5-bis(2-phenylcarbazol-9-yl)benzonitrile?
The IUPAC name of 9-[5-cyano-2-(3-cyanocarbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole-3-carbonitrile;9-[5-cyano-2-[6-cyano-2-[(Z)-prop-1-enyl]indol-1-yl]-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole-2-carbonitrile;9-[2-(3-cyano-6-isocyanocarbazol-9-yl)-4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole-3,6-dicarbonitrile;9-[2-(2,7-diisocyanocarbazol-9-yl)-5-isocyano-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-7-isocyanocarbazole-2-carbonitrile;9-[2-(2,7-diphenylcarbazol-9-yl)-4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-2,7-diphenylcarbazole;9-[2-(3,6-diphenylcarbazol-9-yl)-4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-3,6-diphenylcarbazole;9-[4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]-2-(3-phenylcarbazol-9-yl)phenyl]-3-phenylcarbazole;2-[3-methyl-5-(trifluoromethyl)phenyl]-4,5-bis(2-phenylcarbazol-9-yl)benzonitrile (CID 159905857) is 9-[5-cyano-2-(3-cyanocarbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole-3-carbonitrile;9-[5-cyano-2-[6-cyano-2-[(Z)-prop-1-enyl]indol-1-yl]-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole-2-carbonitrile;9-[2-(3-cyano-6-isocyanocarbazol-9-yl)-4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole-3,6-dicarbonitrile;9-[2-(2,7-diisocyanocarbazol-9-yl)-5-isocyano-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-7-isocyanocarbazole-2-carbonitrile;9-[2-(2,7-diphenylcarbazol-9-yl)-4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-2,7-diphenylcarbazole;9-[2-(3,6-diphenylcarbazol-9-yl)-4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-3,6-diphenylcarbazole;9-[4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]-2-(3-phenylcarbazol-9-yl)phenyl]-3-phenylcarbazole;2-[3-methyl-5-(trifluoromethyl)phenyl]-4,5-bis(2-phenylcarbazol-9-yl)benzonitrile.
What is the SMILES notation for 9-[5-cyano-2-(3-cyanocarbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole-3-carbonitrile;9-[5-cyano-2-[6-cyano-2-[(Z)-prop-1-enyl]indol-1-yl]-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole-2-carbonitrile;9-[2-(3-cyano-6-isocyanocarbazol-9-yl)-4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole-3,6-dicarbonitrile;9-[2-(2,7-diisocyanocarbazol-9-yl)-5-isocyano-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-7-isocyanocarbazole-2-carbonitrile;9-[2-(2,7-diphenylcarbazol-9-yl)-4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-2,7-diphenylcarbazole;9-[2-(3,6-diphenylcarbazol-9-yl)-4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-3,6-diphenylcarbazole;9-[4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]-2-(3-phenylcarbazol-9-yl)phenyl]-3-phenylcarbazole;2-[3-methyl-5-(trifluoromethyl)phenyl]-4,5-bis(2-phenylcarbazol-9-yl)benzonitrile?
The canonical SMILES for 9-[5-cyano-2-(3-cyanocarbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole-3-carbonitrile;9-[5-cyano-2-[6-cyano-2-[(Z)-prop-1-enyl]indol-1-yl]-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole-2-carbonitrile;9-[2-(3-cyano-6-isocyanocarbazol-9-yl)-4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole-3,6-dicarbonitrile;9-[2-(2,7-diisocyanocarbazol-9-yl)-5-isocyano-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-7-isocyanocarbazole-2-carbonitrile;9-[2-(2,7-diphenylcarbazol-9-yl)-4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-2,7-diphenylcarbazole;9-[2-(3,6-diphenylcarbazol-9-yl)-4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-3,6-diphenylcarbazole;9-[4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]-2-(3-phenylcarbazol-9-yl)phenyl]-3-phenylcarbazole;2-[3-methyl-5-(trifluoromethyl)phenyl]-4,5-bis(2-phenylcarbazol-9-yl)benzonitrile is C/C=C\c1cc2ccc(C#N)cc2n1-c1cc(-c2cc(C)cc(C(F)(F)F)c2)c(C#N)cc1-n1c2ccccc2c2ccc(C#N)cc21.Cc1cc(-c2cc(-n3c4ccccc4c4cc(C#N)ccc43)c(-n3c4ccccc4c4cc(C#N)ccc43)cc2C#N)cc(C(F)(F)F)c1.Cc1cc(-c2cc(-n3c4ccccc4c4ccc(-c5ccccc5)cc43)c(-n3c4ccccc4c4ccc(-c5ccccc5)cc43)cc2C#N)cc(C(F)(F)F)c1.[C-]#[N+]c1cc(-n2c3cc(-c4ccccc4)ccc3c3ccc(-c4ccccc4)cc32)c(-n2c3cc(-c4ccccc4)ccc3c3ccc(-c4ccccc4)cc32)cc1-c1cc(C)cc(C(F)(F)F)c1.[C-]#[N+]c1cc(-n2c3ccc(-c4ccccc4)cc3c3cc(-c4ccccc4)ccc32)c(-n2c3ccc(-c4ccccc4)cc3c3cc(-c4ccccc4)ccc32)cc1-c1cc(C)cc(C(F)(F)F)c1.[C-]#[N+]c1cc(-n2c3ccccc3c3cc(-c4ccccc4)ccc32)c(-n2c3ccccc3c3cc(-c4ccccc4)ccc32)cc1-c1cc(C)cc(C(F)(F)F)c1.[C-]#[N+]c1ccc2c(c1)c1cc(C#N)ccc1n2-c1cc([N+]#[C-])c(-c2cc(C)cc(C(F)(F)F)c2)cc1-n1c2ccc(C#N)cc2c2cc(C#N)ccc21.[C-]#[N+]c1ccc2c3ccc(C#N)cc3n(-c3cc([N+]#[C-])c(-c4cc(C)cc(C(F)(F)F)c4)cc3-n3c4cc([N+]#[C-])ccc4c4ccc([N+]#[C-])cc43)c2c1.
What is the InChIKey of 9-[5-cyano-2-(3-cyanocarbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole-3-carbonitrile;9-[5-cyano-2-[6-cyano-2-[(Z)-prop-1-enyl]indol-1-yl]-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole-2-carbonitrile;9-[2-(3-cyano-6-isocyanocarbazol-9-yl)-4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole-3,6-dicarbonitrile;9-[2-(2,7-diisocyanocarbazol-9-yl)-5-isocyano-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-7-isocyanocarbazole-2-carbonitrile;9-[2-(2,7-diphenylcarbazol-9-yl)-4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-2,7-diphenylcarbazole;9-[2-(3,6-diphenylcarbazol-9-yl)-4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-3,6-diphenylcarbazole;9-[4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]-2-(3-phenylcarbazol-9-yl)phenyl]-3-phenylcarbazole;2-[3-methyl-5-(trifluoromethyl)phenyl]-4,5-bis(2-phenylcarbazol-9-yl)benzonitrile?
The InChIKey is NWOFVYXZFXQZCV-OMDYRWHESA-N. The full InChI is InChI=1S/2C63H40F3N3.2C51H32F3N3.2C43H20F3N7.C41H22F3N5.C40H24F3N5/c1-40-31-49(33-50(32-40)63(64,65)66)51-38-61(68-57-27-23-45(41-15-7-3-8-16-41)34-52(57)53-35-46(24-28-58(53)68)42-17-9-4-10-18-42)62(39-56(51)67-2)69-59-29-25-47(43-19-11-5-12-20-43)36-54(59)55-37-48(26-30-60(55)69)44-21-13-6-14-22-44;1-40-31-49(33-50(32-40)63(64,65)66)55-38-61(68-57-34-45(41-15-7-3-8-16-41)23-27-51(57)52-28-24-46(35-58(52)68)42-17-9-4-10-18-42)62(39-56(55)67-2)69-59-36-47(43-19-11-5-12-20-43)25-29-53(59)54-30-26-48(37-60(54)69)44-21-13-6-14-22-44;1-32-25-37(27-38(26-32)51(52,53)54)41-30-49(56-45-19-11-9-17-39(45)42-28-35(21-23-47(42)56)33-13-5-3-6-14-33)50(31-44(41)55-2)57-46-20-12-10-18-40(46)43-29-36(22-24-48(43)57)34-15-7-4-8-16-34;1-32-24-37(26-39(25-32)51(52,53)54)44-30-50(57-46-19-11-9-17-41(46)43-23-21-36(28-48(43)57)34-14-6-3-7-15-34)49(29-38(44)31-55)56-45-18-10-8-16-40(45)42-22-20-35(27-47(42)56)33-12-4-2-5-13-33;1-24-14-26(17-27(15-24)43(44,45)46)35-21-41(53-39-19-29(49-3)8-12-33(39)34-13-9-30(50-4)20-40(34)53)42(22-36(35)51-5)52-37-16-25(23-47)6-10-31(37)32-11-7-28(48-2)18-38(32)52;1-24-12-28(17-29(13-24)43(44,45)46)31-19-41(52-37-8-4-25(21-47)14-32(37)33-15-26(22-48)5-9-38(33)52)42(20-36(31)51-3)53-39-10-6-27(23-49)16-34(39)35-18-30(50-2)7-11-40(35)53;1-24-14-27(18-29(15-24)41(42,43)44)32-20-40(49-36-9-5-3-7-31(36)34-17-26(22-46)11-13-38(34)49)39(19-28(32)23-47)48-35-8-4-2-6-30(35)33-16-25(21-45)10-12-37(33)48;1-3-6-31-18-27-11-9-25(21-44)15-36(27)47(31)39-20-34(28-13-24(2)14-30(17-28)40(41,42)43)29(23-46)19-38(39)48-35-8-5-4-7-32(35)33-12-10-26(22-45)16-37(33)48/h2*3-39H,1H3;3-31H,1H3;2-30H,1H3;6-22H,1H3;4-20H,1H3;2-20H,1H3;3-20H,1-2H3/b;;;;;;;6-3-.
What are the key properties of 9-[5-cyano-2-(3-cyanocarbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole-3-carbonitrile;9-[5-cyano-2-[6-cyano-2-[(Z)-prop-1-enyl]indol-1-yl]-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole-2-carbonitrile;9-[2-(3-cyano-6-isocyanocarbazol-9-yl)-4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole-3,6-dicarbonitrile;9-[2-(2,7-diisocyanocarbazol-9-yl)-5-isocyano-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-7-isocyanocarbazole-2-carbonitrile;9-[2-(2,7-diphenylcarbazol-9-yl)-4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-2,7-diphenylcarbazole;9-[2-(3,6-diphenylcarbazol-9-yl)-4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-3,6-diphenylcarbazole;9-[4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]-2-(3-phenylcarbazol-9-yl)phenyl]-3-phenylcarbazole;2-[3-methyl-5-(trifluoromethyl)phenyl]-4,5-bis(2-phenylcarbazol-9-yl)benzonitrile?
9-[5-cyano-2-(3-cyanocarbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole-3-carbonitrile;9-[5-cyano-2-[6-cyano-2-[(Z)-prop-1-enyl]indol-1-yl]-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole-2-carbonitrile;9-[2-(3-cyano-6-isocyanocarbazol-9-yl)-4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole-3,6-dicarbonitrile;9-[2-(2,7-diisocyanocarbazol-9-yl)-5-isocyano-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-7-isocyanocarbazole-2-carbonitrile;9-[2-(2,7-diphenylcarbazol-9-yl)-4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-2,7-diphenylcarbazole;9-[2-(3,6-diphenylcarbazol-9-yl)-4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-3,6-diphenylcarbazole;9-[4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]-2-(3-phenylcarbazol-9-yl)phenyl]-3-phenylcarbazole;2-[3-methyl-5-(trifluoromethyl)phenyl]-4,5-bis(2-phenylcarbazol-9-yl)benzonitrile has a molecular weight of 5936.39 g/mol, XLogP of 110.43, 37 rotatable bonds, 0 hydrogen bond donors, and 27 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[5-cyano-2-(3-cyanocarbazol-9-yl)-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole-3-carbonitrile;9-[5-cyano-2-[6-cyano-2-[(Z)-prop-1-enyl]indol-1-yl]-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole-2-carbonitrile;9-[2-(3-cyano-6-isocyanocarbazol-9-yl)-4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole-3,6-dicarbonitrile;9-[2-(2,7-diisocyanocarbazol-9-yl)-5-isocyano-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-7-isocyanocarbazole-2-carbonitrile;9-[2-(2,7-diphenylcarbazol-9-yl)-4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-2,7-diphenylcarbazole;9-[2-(3,6-diphenylcarbazol-9-yl)-4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]-3,6-diphenylcarbazole;9-[4-isocyano-5-[3-methyl-5-(trifluoromethyl)phenyl]-2-(3-phenylcarbazol-9-yl)phenyl]-3-phenylcarbazole;2-[3-methyl-5-(trifluoromethyl)phenyl]-4,5-bis(2-phenylcarbazol-9-yl)benzonitrile is sourced from PubChem (CID 159905857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).