2,6-bis([1]benzofuro[2,3-a]carbazol-12-yl)-4-[2-cyano-4-(trifluoromethyl)phenyl]benzonitrile;2,6-bis([1]benzofuro[3,2-a]carbazol-12-yl)-4-[4-cyano-2-(trifluoromethyl)phenyl]benzonitrile;2,6-bis([1]benzothiolo[3,2-a]carbazol-12-yl)-4-[4-cyano-2-(trifluoromethyl)phenyl]benzonitrile;4-[4-cyano-2-(trifluoromethyl)phenyl]-2,6-bis(7H-indeno[1,2-a]carbazol-12-yl)benzonitrile;4-[2-cyano-4-(trifluoromethyl)phenyl]-2-(7H-indeno[1,2-a]carbazol-12-yl)-6-(5H-indolo[3,2-c]carbazol-12-yl)benzonitrile;4-[4-cyano-2-(trifluoromethyl)phenyl]-2-(7H-indeno[1,2-a]carbazol-12-yl)-6-(5H-indolo[3,2-c]carbazol-12-yl)benzonitrile

C310H160F18N26O4S2 — CID 162096108

IUPAC2,6-bis([1]benzofuro[2,3-a]carbazol-12-yl)-4-[2-cyano-4-(trifluoromethyl)phenyl]benzonitrile;2,6-bis([1]benzofuro[3,2-a]carbazol-12-yl)-4-[4-cyano-2-(trifluoromethyl)phenyl]benzonitrile;2,6-bis([1]benzothiolo[3,2-a]carbazol-12-yl)-4-[4-cyano-2-(trifluoromethyl)phenyl]benzonitrile;4-[4-cyano-2-(trifluoromethyl)phenyl]-2,6-bis(7H-indeno[1,2-a]carbazol-12-yl)benzonitrile;4-[2-cyano-4-(trifluoromethyl)phenyl]-2-(7H-indeno[1,2-a]carbazol-12-yl)-6-(5H-indolo[3,2-c]carbazol-12-yl)benzonitrile;4-[4-cyano-2-(trifluoromethyl)phenyl]-2-(7H-indeno[1,2-a]carbazol-12-yl)-6-(5H-indolo[3,2-c]carbazol-12-yl)benzonitrile
SMILESN#Cc1cc(C(F)(F)F)ccc1-c1cc(-n2c3ccccc3c3ccc4c(c32)-c2ccccc2C4)c(C#N)c(-n2c3ccccc3c3ccc4[nH]c5ccccc5c4c32)c1.N#Cc1cc(C(F)(F)F)ccc1-c1cc(-n2c3ccccc3c3ccc4c5ccccc5oc4c32)c(C#N)c(-n2c3ccccc3c3ccc4c5ccccc5oc4c32)c1.N#Cc1ccc(-c2cc(-n3c4ccccc4c4ccc5c(c43)-c3ccccc3C5)c(C#N)c(-n3c4ccccc4c4ccc5[nH]c6ccccc6c5c43)c2)c(C(F)(F)F)c1.N#Cc1ccc(-c2cc(-n3c4ccccc4c4ccc5c(c43)-c3ccccc3C5)c(C#N)c(-n3c4ccccc4c4ccc5c(c43)-c3ccccc3C5)c2)c(C(F)(F)F)c1.N#Cc1ccc(-c2cc(-n3c4ccccc4c4ccc5oc6ccccc6c5c43)c(C#N)c(-n3c4ccccc4c4ccc5oc6ccccc6c5c43)c2)c(C(F)(F)F)c1.N#Cc1ccc(-c2cc(-n3c4ccccc4c4ccc5sc6ccccc6c5c43)c(C#N)c(-n3c4ccccc4c4ccc5sc6ccccc6c5c43)c2)c(C(F)(F)F)c1
InChIInChI=1S/C53H29F3N4.2C52H28F3N5.2C51H25F3N4O2.C51H25F3N4S2/c54-53(55,56)44-23-30(28-57)17-20-36(44)35-26-47(59-45-15-7-5-13-39(45)41-21-18-33-24-31-9-1-3-11-37(31)49(33)51(41)59)43(29-58)48(27-35)60-46-16-8-6-14-40(46)42-22-19-34-25-32-10-2-4-12-38(32)50(34)52(42)60;53-52(54,55)41-23-29(27-56)17-19-33(41)32-25-46(59-44-15-7-4-11-35(44)37-20-18-31-24-30-9-1-2-10-34(30)48(31)50(37)59)40(28-57)47(26-32)60-45-16-8-5-12-36(45)38-21-22-43-49(51(38)60)39-13-3-6-14-42(39)58-43;53-52(54,55)33-18-20-34(32(24-33)27-56)31-25-46(59-44-15-7-4-11-36(44)38-19-17-30-23-29-9-1-2-10-35(29)48(30)50(38)59)41(28-57)47(26-31)60-45-16-8-5-12-37(45)39-21-22-43-49(51(39)60)40-13-3-6-14-42(40)58-43;52-51(53,54)30-17-18-31(29(23-30)26-55)28-24-43(57-41-13-5-1-9-32(41)36-19-21-38-34-11-3-7-15-45(34)59-49(38)47(36)57)40(27-56)44(25-28)58-42-14-6-2-10-33(42)37-20-22-39-35-12-4-8-16-46(35)60-50(39)48(37)58;2*52-51(53,54)38-23-28(26-55)17-18-30(38)29-24-41(57-39-13-5-1-9-31(39)33-19-21-45-47(49(33)57)35-11-3-7-15-43(35)59-45)37(27-56)42(25-29)58-40-14-6-2-10-32(40)34-20-22-46-48(50(34)58)36-12-4-8-16-44(36)60-46/h1-23,26-27H,24-25H2;1-23,25-26,58H,24H2;1-22,24-26,58H,23H2;3*1-25H
InChIKeyZEGNXQPXEDKGKX-UHFFFAOYSA-N
MW4718.97 g/mol
LogP83.75
Rot. Bonds18

About 2,6-bis([1]benzofuro[2,3-a]carbazol-12-yl)-4-[2-cyano-4-(trifluoromethyl)phenyl]benzonitrile;2,6-bis([1]benzofuro[3,2-a]carbazol-12-yl)-4-[4-cyano-2-(trifluoromethyl)phenyl]benzonitrile;2,6-bis([1]benzothiolo[3,2-a]carbazol-12-yl)-4-[4-cyano-2-(trifluoromethyl)phenyl]benzonitrile;4-[4-cyano-2-(trifluoromethyl)phenyl]-2,6-bis(7H-indeno[1,2-a]carbazol-12-yl)benzonitrile;4-[2-cyano-4-(trifluoromethyl)phenyl]-2-(7H-indeno[1,2-a]carbazol-12-yl)-6-(5H-indolo[3,2-c]carbazol-12-yl)benzonitrile;4-[4-cyano-2-(trifluoromethyl)phenyl]-2-(7H-indeno[1,2-a]carbazol-12-yl)-6-(5H-indolo[3,2-c]carbazol-12-yl)benzonitrile

2,6-bis([1]benzofuro[2,3-a]carbazol-12-yl)-4-[2-cyano-4-(trifluoromethyl)phenyl]benzonitrile;2,6-bis([1]benzofuro[3,2-a]carbazol-12-yl)-4-[4-cyano-2-(trifluoromethyl)phenyl]benzonitrile;2,6-bis([1]benzothiolo[3,2-a]carbazol-12-yl)-4-[4-cyano-2-(trifluoromethyl)phenyl]benzonitrile;4-[4-cyano-2-(trifluoromethyl)phenyl]-2,6-bis(7H-indeno[1,2-a]carbazol-12-yl)benzonitrile;4-[2-cyano-4-(trifluoromethyl)phenyl]-2-(7H-indeno[1,2-a]carbazol-12-yl)-6-(5H-indolo[3,2-c]carbazol-12-yl)benzonitrile;4-[4-cyano-2-(trifluoromethyl)phenyl]-2-(7H-indeno[1,2-a]carbazol-12-yl)-6-(5H-indolo[3,2-c]carbazol-12-yl)benzonitrile (PubChem CID 162096108) has the molecular formula C310H160F18N26O4S2 and a molecular weight of 4718.97 g/mol. Its IUPAC name is 2,6-bis([1]benzofuro[2,3-a]carbazol-12-yl)-4-[2-cyano-4-(trifluoromethyl)phenyl]benzonitrile;2,6-bis([1]benzofuro[3,2-a]carbazol-12-yl)-4-[4-cyano-2-(trifluoromethyl)phenyl]benzonitrile;2,6-bis([1]benzothiolo[3,2-a]carbazol-12-yl)-4-[4-cyano-2-(trifluoromethyl)phenyl]benzonitrile;4-[4-cyano-2-(trifluoromethyl)phenyl]-2,6-bis(7H-indeno[1,2-a]carbazol-12-yl)benzonitrile;4-[2-cyano-4-(trifluoromethyl)phenyl]-2-(7H-indeno[1,2-a]carbazol-12-yl)-6-(5H-indolo[3,2-c]carbazol-12-yl)benzonitrile;4-[4-cyano-2-(trifluoromethyl)phenyl]-2-(7H-indeno[1,2-a]carbazol-12-yl)-6-(5H-indolo[3,2-c]carbazol-12-yl)benzonitrile.

Molecular Properties

Compound Name2,6-bis([1]benzofuro[2,3-a]carbazol-12-yl)-4-[2-cyano-4-(trifluoromethyl)phenyl]benzonitrile;2,6-bis([1]benzofuro[3,2-a]carbazol-12-yl)-4-[4-cyano-2-(trifluoromethyl)phenyl]benzonitrile;2,6-bis([1]benzothiolo[3,2-a]carbazol-12-yl)-4-[4-cyano-2-(trifluoromethyl)phenyl]benzonitrile;4-[4-cyano-2-(trifluoromethyl)phenyl]-2,6-bis(7H-indeno[1,2-a]carbazol-12-yl)benzonitrile;4-[2-cyano-4-(trifluoromethyl)phenyl]-2-(7H-indeno[1,2-a]carbazol-12-yl)-6-(5H-indolo[3,2-c]carbazol-12-yl)benzonitrile;4-[4-cyano-2-(trifluoromethyl)phenyl]-2-(7H-indeno[1,2-a]carbazol-12-yl)-6-(5H-indolo[3,2-c]carbazol-12-yl)benzonitrile
PubChem CID162096108
Molecular FormulaC310H160F18N26O4S2
Molecular Weight4718.97 g/mol
Exact Mass4715.23
IUPAC Name2,6-bis([1]benzofuro[2,3-a]carbazol-12-yl)-4-[2-cyano-4-(trifluoromethyl)phenyl]benzonitrile;2,6-bis([1]benzofuro[3,2-a]carbazol-12-yl)-4-[4-cyano-2-(trifluoromethyl)phenyl]benzonitrile;2,6-bis([1]benzothiolo[3,2-a]carbazol-12-yl)-4-[4-cyano-2-(trifluoromethyl)phenyl]benzonitrile;4-[4-cyano-2-(trifluoromethyl)phenyl]-2,6-bis(7H-indeno[1,2-a]carbazol-12-yl)benzonitrile;4-[2-cyano-4-(trifluoromethyl)phenyl]-2-(7H-indeno[1,2-a]carbazol-12-yl)-6-(5H-indolo[3,2-c]carbazol-12-yl)benzonitrile;4-[4-cyano-2-(trifluoromethyl)phenyl]-2-(7H-indeno[1,2-a]carbazol-12-yl)-6-(5H-indolo[3,2-c]carbazol-12-yl)benzonitrile
SMILESN#Cc1cc(C(F)(F)F)ccc1-c1cc(-n2c3ccccc3c3ccc4c(c32)-c2ccccc2C4)c(C#N)c(-n2c3ccccc3c3ccc4[nH]c5ccccc5c4c32)c1.N#Cc1cc(C(F)(F)F)ccc1-c1cc(-n2c3ccccc3c3ccc4c5ccccc5oc4c32)c(C#N)c(-n2c3ccccc3c3ccc4c5ccccc5oc4c32)c1.N#Cc1ccc(-c2cc(-n3c4ccccc4c4ccc5c(c43)-c3ccccc3C5)c(C#N)c(-n3c4ccccc4c4ccc5[nH]c6ccccc6c5c43)c2)c(C(F)(F)F)c1.N#Cc1ccc(-c2cc(-n3c4ccccc4c4ccc5c(c43)-c3ccccc3C5)c(C#N)c(-n3c4ccccc4c4ccc5c(c43)-c3ccccc3C5)c2)c(C(F)(F)F)c1.N#Cc1ccc(-c2cc(-n3c4ccccc4c4ccc5oc6ccccc6c5c43)c(C#N)c(-n3c4ccccc4c4ccc5oc6ccccc6c5c43)c2)c(C(F)(F)F)c1.N#Cc1ccc(-c2cc(-n3c4ccccc4c4ccc5sc6ccccc6c5c43)c(C#N)c(-n3c4ccccc4c4ccc5sc6ccccc6c5c43)c2)c(C(F)(F)F)c1
InChIInChI=1S/C53H29F3N4.2C52H28F3N5.2C51H25F3N4O2.C51H25F3N4S2/c54-53(55,56)44-23-30(28-57)17-20-36(44)35-26-47(59-45-15-7-5-13-39(45)41-21-18-33-24-31-9-1-3-11-37(31)49(33)51(41)59)43(29-58)48(27-35)60-46-16-8-6-14-40(46)42-22-19-34-25-32-10-2-4-12-38(32)50(34)52(42)60;53-52(54,55)41-23-29(27-56)17-19-33(41)32-25-46(59-44-15-7-4-11-35(44)37-20-18-31-24-30-9-1-2-10-34(30)48(31)50(37)59)40(28-57)47(26-32)60-45-16-8-5-12-36(45)38-21-22-43-49(51(38)60)39-13-3-6-14-42(39)58-43;53-52(54,55)33-18-20-34(32(24-33)27-56)31-25-46(59-44-15-7-4-11-36(44)38-19-17-30-23-29-9-1-2-10-35(29)48(30)50(38)59)41(28-57)47(26-31)60-45-16-8-5-12-37(45)39-21-22-43-49(51(39)60)40-13-3-6-14-42(40)58-43;52-51(53,54)30-17-18-31(29(23-30)26-55)28-24-43(57-41-13-5-1-9-32(41)36-19-21-38-34-11-3-7-15-45(34)59-49(38)47(36)57)40(27-56)44(25-28)58-42-14-6-2-10-33(42)37-20-22-39-35-12-4-8-16-46(35)60-50(39)48(37)58;2*52-51(53,54)38-23-28(26-55)17-18-30(38)29-24-41(57-39-13-5-1-9-31(39)33-19-21-45-47(49(33)57)35-11-3-7-15-43(35)59-45)37(27-56)42(25-29)58-40-14-6-2-10-32(40)34-20-22-46-48(50(34)58)36-12-4-8-16-44(36)60-46/h1-23,26-27H,24-25H2;1-23,25-26,58H,24H2;1-22,24-26,58H,23H2;3*1-25H
InChIKeyZEGNXQPXEDKGKX-UHFFFAOYSA-N
XLogP83.75
TPSA428.78 Ų
H-Bond Donors2
H-Bond Acceptors30
Rotatable Bonds18
Heavy Atoms360
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004718.97
LogP ≤ 583.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1030

Analyze 2,6-bis([1]benzofuro[2,3-a]carbazol-12-yl)-4-[2-cyano-4-(trifluoromethyl)phenyl]benzonitrile;2,6-bis([1]benzofuro[3,2-a]carbazol-12-yl)-4-[4-cyano-2-(trifluoromethyl)phenyl]benzonitrile;2,6-bis([1]benzothiolo[3,2-a]carbazol-12-yl)-4-[4-cyano-2-(trifluoromethyl)phenyl]benzonitrile;4-[4-cyano-2-(trifluoromethyl)phenyl]-2,6-bis(7H-indeno[1,2-a]carbazol-12-yl)benzonitrile;4-[2-cyano-4-(trifluoromethyl)phenyl]-2-(7H-indeno[1,2-a]carbazol-12-yl)-6-(5H-indolo[3,2-c]carbazol-12-yl)benzonitrile;4-[4-cyano-2-(trifluoromethyl)phenyl]-2-(7H-indeno[1,2-a]carbazol-12-yl)-6-(5H-indolo[3,2-c]carbazol-12-yl)benzonitrile with MolForge

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Related Compounds

4-([1]Benzofuro[3,2-c]carbazol-5-yl)-3-[2-[3-[5-[2-[2-([1]benzothiolo[3,2-c]carbazol-5-yl)-5-cyanophenyl]-4-[3,5-bis(trifluoromethyl)phenyl]phenyl]-[1]benzothiolo[2,3-g]carbazol-3-yl]-[1]benzofuro[3,2-c]carbazol-5-yl]-5-[3,5-bis(trifluoromethyl)phenyl]phenyl]benzonitrile
CID 138499590
3-([1]Benzofuro[3,2-a]carbazol-12-yl)-5-[3-[12-[3-([1]benzofuro[2,3-a]carbazol-12-yl)-2-[2,6-bis(trifluoromethyl)phenyl]-5-cyanophenyl]-[1]benzofuro[2,3-a]carbazol-2-yl]-[1]benzofuro[3,2-a]carbazol-12-yl]-4-[2,6-bis(trifluoromethyl)phenyl]benzonitrile
CID 146520021
2,6-bis([1]benzofuro[3,2-b]carbazol-11-yl)-4-[2-cyano-4-(trifluoromethyl)phenyl]benzonitrile;2,6-bis([1]benzofuro[3,2-b]carbazol-11-yl)-4-[4-cyano-2-(trifluoromethyl)phenyl]benzonitrile;2,6-bis([1]benzothiolo[3,2-b]carbazol-11-yl)-4-[2-cyano-4-(trifluoromethyl)phenyl]benzonitrile;4-[2-cyano-4-(trifluoromethyl)phenyl]-2,6-bis(11H-indeno[1,2-b]carbazol-5-yl)benzonitrile;4-[4-cyano-2-(trifluoromethyl)phenyl]-2,6-bis(11H-indolo[2,3-a]carbazol-12-yl)benzonitrile;4-[2-cyano-4-(trifluoromethyl)phenyl]-2,6-bis(11H-indolo[3,2-b]carbazol-5-yl)benzonitrile
CID 157186735
4-([1]Benzofuro[3,2-c]carbazol-5-yl)-3-[2-([1]benzofuro[3,2-c]carbazol-5-yl)-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]benzonitrile;4-([1]benzothiolo[3,2-c]carbazol-5-yl)-3-[2-([1]benzothiolo[3,2-c]carbazol-5-yl)-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]benzonitrile;4-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)-3-[2-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]benzonitrile;9-[3-isocyano-2-[2-(3-methylcarbazol-9-yl)-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]phenyl]-3-methylcarbazole;3-[5-[3-methyl-5-(trifluoromethyl)phenyl]-2-(7-phenylindolo[2,3-b]carbazol-5-yl)phenyl]-4-(7-phenylindolo[2,3-b]carbazol-5-yl)benzonitrile;3-[5-[3-methyl-5-(trifluoromethyl)phenyl]-2-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-4-(12-phenylindolo[3,2-c]carbazol-5-yl)benzonitrile
CID 157265144
7-N-(7,9-dimethylcarbazol-2-yl)-7-N-(2,4-dimethylphenyl)-2-N,9-dimethyl-2-N-[4-(trifluoromethyl)phenyl]carbazole-2,7-diamine;7-N-(7,9-dimethylcarbazol-2-yl)-2-N-(4-fluorophenyl)-2-N,9-dimethyl-7-N-phenylcarbazole-2,7-diamine;2-N-(2,4-dimethylphenyl)-7-N,9,9-trimethyl-7-N-[4-(trifluoromethyl)phenyl]-2-N-(7,9,9-trimethylfluoren-2-yl)fluorene-2,7-diamine;3-N-(4-fluorophenyl)-3-N-methyl-7-N-(7-methyldibenzofuran-3-yl)-7-N-phenyldibenzofuran-3,7-diamine;3-N-(4-fluorophenyl)-3-N-methyl-7-N-(7-methyldibenzothiophen-3-yl)-7-N-phenyldibenzothiophene-3,7-diamine
CID 157716668
7-N-(7,9-dimethylcarbazol-2-yl)-2-N,9-dimethyl-7-N-(4-methylphenyl)-2-N-[4-(trifluoromethyl)phenyl]carbazole-2,7-diamine;7-N-(2,4-dimethylphenyl)-3-N-methyl-7-N-(7-methyldibenzofuran-3-yl)-3-N-[4-(trifluoromethyl)phenyl]dibenzofuran-3,7-diamine;7-N-(2,4-dimethylphenyl)-3-N-methyl-7-N-(7-methyldibenzothiophen-3-yl)-3-N-[4-(trifluoromethyl)phenyl]dibenzothiophene-3,7-diamine;3-N-methyl-7-N-(7-methyldibenzothiophen-3-yl)-7-N-(4-methylphenyl)-3-N-[4-(trifluoromethyl)phenyl]dibenzothiophene-3,7-diamine;7-N,9,9-trimethyl-2-N-(4-methylphenyl)-7-N-[4-(trifluoromethyl)phenyl]-2-N-(7,9,9-trimethylfluoren-2-yl)fluorene-2,7-diamine
CID 157733997
12-[3-([1]Benzofuro[2,3-a]carbazol-12-yl)-2-(3,5-difluorophenyl)-5-(trifluoromethyl)phenyl]-[1]benzofuro[2,3-a]carbazole;12-[3-([1]benzofuro[3,2-a]carbazol-12-yl)-2-(3,5-difluorophenyl)-5-(trifluoromethyl)phenyl]-[1]benzofuro[3,2-a]carbazole;12-[3-([1]benzothiolo[3,2-a]carbazol-12-yl)-2-(3,5-difluorophenyl)-5-(trifluoromethyl)phenyl]-[1]benzothiolo[3,2-a]carbazole;9-[2-(2,6-difluorophenyl)-3-(2-methylcarbazol-9-yl)-5-(trifluoromethyl)phenyl]-2-methylcarbazole;9-[2-(2,6-difluorophenyl)-3-(3-methylcarbazol-9-yl)-5-(trifluoromethyl)phenyl]-3-methylcarbazole
CID 157918201
CID 157991336
CID 157991336
12-[3-([1]Benzofuro[2,3-a]carbazol-12-yl)-4-(2,6-difluorophenyl)-2-methylphenyl]-[1]benzofuro[2,3-a]carbazole;12-[3-([1]benzofuro[3,2-a]carbazol-12-yl)-4-(2,6-difluorophenyl)-2-(trifluoromethyl)phenyl]-[1]benzofuro[3,2-a]carbazole;12-[3-([1]benzothiolo[2,3-a]carbazol-12-yl)-4-(2,6-difluorophenyl)-2-methylphenyl]-[1]benzothiolo[2,3-a]carbazole;12-[3-([1]benzothiolo[3,2-a]carbazol-12-yl)-4-(2,6-difluorophenyl)-2-(trifluoromethyl)phenyl]-[1]benzothiolo[3,2-a]carbazole
CID 158304035
7-N-(7,9-dimethylcarbazol-2-yl)-2-N,9-dimethyl-7-N-(4-methylphenyl)-2-N-[4-(trifluoromethyl)phenyl]carbazole-2,7-diamine;7-N-(2,4-dimethylphenyl)-3-N-methyl-7-N-(7-methyldibenzofuran-3-yl)-3-N-[4-(trifluoromethyl)phenyl]dibenzofuran-3,7-diamine;7-N-(2,4-dimethylphenyl)-3-N-methyl-7-N-(7-methyldibenzothiophen-3-yl)-3-N-[4-(trifluoromethyl)phenyl]dibenzothiophene-3,7-diamine;ethane;3-N-methyl-7-N-(7-methyldibenzothiophen-3-yl)-7-N-(4-methylphenyl)-3-N-[4-(trifluoromethyl)phenyl]dibenzothiophene-3,7-diamine;7-N,9,9-trimethyl-2-N-(4-methylphenyl)-7-N-[4-(trifluoromethyl)phenyl]-2-N-(7,9,9-trimethylfluoren-2-yl)fluorene-2,7-diamine
CID 158434096
2,6-bis([1]benzofuro[2,3-a]carbazol-12-yl)-4-[4-cyano-2-(trifluoromethyl)phenyl]benzonitrile;2,6-bis([1]benzothiolo[2,3-a]carbazol-12-yl)-4-[2-cyano-4-(trifluoromethyl)phenyl]benzonitrile;2,6-bis([1]benzothiolo[2,3-a]carbazol-12-yl)-4-[4-cyano-2-(trifluoromethyl)phenyl]benzonitrile;4-[2-cyano-4-(trifluoromethyl)phenyl]-2,6-bis(12H-indeno[2,1-a]carbazol-11-yl)benzonitrile;4-[4-cyano-2-(trifluoromethyl)phenyl]-2,6-bis(12H-indeno[2,1-a]carbazol-11-yl)benzonitrile;4-[2-cyano-4-(trifluoromethyl)phenyl]-2,6-bis(11H-indolo[2,3-a]carbazol-12-yl)benzonitrile
CID 158465957
3-([1]Benzofuro[3,2-c]carbazol-5-yl)-4-[2-([1]benzofuro[3,2-c]carbazol-5-yl)-5-[3,5-bis(trifluoromethyl)phenyl]phenyl]benzonitrile;3-([1]benzothiolo[3,2-c]carbazol-5-yl)-4-[2-([1]benzothiolo[3,2-c]carbazol-5-yl)-5-[3,5-bis(trifluoromethyl)phenyl]phenyl]benzonitrile;4-[5-[3,5-bis(trifluoromethyl)phenyl]-2-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]-3-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)benzonitrile;5-[4-[3,5-bis(trifluoromethyl)phenyl]-2-[4-isocyano-2-(7-phenylindolo[2,3-b]carbazol-5-yl)phenyl]phenyl]-7-phenylindolo[2,3-b]carbazole;4-[5-[3,5-bis(trifluoromethyl)phenyl]-2-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-3-(12-phenylindolo[3,2-c]carbazol-5-yl)benzonitrile;4-(3-methylcarbazol-9-yl)-3-[2-(3-methylcarbazol-9-yl)-5-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]benzonitrile
CID 158511309

Frequently Asked Questions

What is the IUPAC name of 2,6-bis([1]benzofuro[2,3-a]carbazol-12-yl)-4-[2-cyano-4-(trifluoromethyl)phenyl]benzonitrile;2,6-bis([1]benzofuro[3,2-a]carbazol-12-yl)-4-[4-cyano-2-(trifluoromethyl)phenyl]benzonitrile;2,6-bis([1]benzothiolo[3,2-a]carbazol-12-yl)-4-[4-cyano-2-(trifluoromethyl)phenyl]benzonitrile;4-[4-cyano-2-(trifluoromethyl)phenyl]-2,6-bis(7H-indeno[1,2-a]carbazol-12-yl)benzonitrile;4-[2-cyano-4-(trifluoromethyl)phenyl]-2-(7H-indeno[1,2-a]carbazol-12-yl)-6-(5H-indolo[3,2-c]carbazol-12-yl)benzonitrile;4-[4-cyano-2-(trifluoromethyl)phenyl]-2-(7H-indeno[1,2-a]carbazol-12-yl)-6-(5H-indolo[3,2-c]carbazol-12-yl)benzonitrile?
The IUPAC name of 2,6-bis([1]benzofuro[2,3-a]carbazol-12-yl)-4-[2-cyano-4-(trifluoromethyl)phenyl]benzonitrile;2,6-bis([1]benzofuro[3,2-a]carbazol-12-yl)-4-[4-cyano-2-(trifluoromethyl)phenyl]benzonitrile;2,6-bis([1]benzothiolo[3,2-a]carbazol-12-yl)-4-[4-cyano-2-(trifluoromethyl)phenyl]benzonitrile;4-[4-cyano-2-(trifluoromethyl)phenyl]-2,6-bis(7H-indeno[1,2-a]carbazol-12-yl)benzonitrile;4-[2-cyano-4-(trifluoromethyl)phenyl]-2-(7H-indeno[1,2-a]carbazol-12-yl)-6-(5H-indolo[3,2-c]carbazol-12-yl)benzonitrile;4-[4-cyano-2-(trifluoromethyl)phenyl]-2-(7H-indeno[1,2-a]carbazol-12-yl)-6-(5H-indolo[3,2-c]carbazol-12-yl)benzonitrile (CID 162096108) is 2,6-bis([1]benzofuro[2,3-a]carbazol-12-yl)-4-[2-cyano-4-(trifluoromethyl)phenyl]benzonitrile;2,6-bis([1]benzofuro[3,2-a]carbazol-12-yl)-4-[4-cyano-2-(trifluoromethyl)phenyl]benzonitrile;2,6-bis([1]benzothiolo[3,2-a]carbazol-12-yl)-4-[4-cyano-2-(trifluoromethyl)phenyl]benzonitrile;4-[4-cyano-2-(trifluoromethyl)phenyl]-2,6-bis(7H-indeno[1,2-a]carbazol-12-yl)benzonitrile;4-[2-cyano-4-(trifluoromethyl)phenyl]-2-(7H-indeno[1,2-a]carbazol-12-yl)-6-(5H-indolo[3,2-c]carbazol-12-yl)benzonitrile;4-[4-cyano-2-(trifluoromethyl)phenyl]-2-(7H-indeno[1,2-a]carbazol-12-yl)-6-(5H-indolo[3,2-c]carbazol-12-yl)benzonitrile.
What is the SMILES notation for 2,6-bis([1]benzofuro[2,3-a]carbazol-12-yl)-4-[2-cyano-4-(trifluoromethyl)phenyl]benzonitrile;2,6-bis([1]benzofuro[3,2-a]carbazol-12-yl)-4-[4-cyano-2-(trifluoromethyl)phenyl]benzonitrile;2,6-bis([1]benzothiolo[3,2-a]carbazol-12-yl)-4-[4-cyano-2-(trifluoromethyl)phenyl]benzonitrile;4-[4-cyano-2-(trifluoromethyl)phenyl]-2,6-bis(7H-indeno[1,2-a]carbazol-12-yl)benzonitrile;4-[2-cyano-4-(trifluoromethyl)phenyl]-2-(7H-indeno[1,2-a]carbazol-12-yl)-6-(5H-indolo[3,2-c]carbazol-12-yl)benzonitrile;4-[4-cyano-2-(trifluoromethyl)phenyl]-2-(7H-indeno[1,2-a]carbazol-12-yl)-6-(5H-indolo[3,2-c]carbazol-12-yl)benzonitrile?
The canonical SMILES for 2,6-bis([1]benzofuro[2,3-a]carbazol-12-yl)-4-[2-cyano-4-(trifluoromethyl)phenyl]benzonitrile;2,6-bis([1]benzofuro[3,2-a]carbazol-12-yl)-4-[4-cyano-2-(trifluoromethyl)phenyl]benzonitrile;2,6-bis([1]benzothiolo[3,2-a]carbazol-12-yl)-4-[4-cyano-2-(trifluoromethyl)phenyl]benzonitrile;4-[4-cyano-2-(trifluoromethyl)phenyl]-2,6-bis(7H-indeno[1,2-a]carbazol-12-yl)benzonitrile;4-[2-cyano-4-(trifluoromethyl)phenyl]-2-(7H-indeno[1,2-a]carbazol-12-yl)-6-(5H-indolo[3,2-c]carbazol-12-yl)benzonitrile;4-[4-cyano-2-(trifluoromethyl)phenyl]-2-(7H-indeno[1,2-a]carbazol-12-yl)-6-(5H-indolo[3,2-c]carbazol-12-yl)benzonitrile is N#Cc1cc(C(F)(F)F)ccc1-c1cc(-n2c3ccccc3c3ccc4c(c32)-c2ccccc2C4)c(C#N)c(-n2c3ccccc3c3ccc4[nH]c5ccccc5c4c32)c1.N#Cc1cc(C(F)(F)F)ccc1-c1cc(-n2c3ccccc3c3ccc4c5ccccc5oc4c32)c(C#N)c(-n2c3ccccc3c3ccc4c5ccccc5oc4c32)c1.N#Cc1ccc(-c2cc(-n3c4ccccc4c4ccc5c(c43)-c3ccccc3C5)c(C#N)c(-n3c4ccccc4c4ccc5[nH]c6ccccc6c5c43)c2)c(C(F)(F)F)c1.N#Cc1ccc(-c2cc(-n3c4ccccc4c4ccc5c(c43)-c3ccccc3C5)c(C#N)c(-n3c4ccccc4c4ccc5c(c43)-c3ccccc3C5)c2)c(C(F)(F)F)c1.N#Cc1ccc(-c2cc(-n3c4ccccc4c4ccc5oc6ccccc6c5c43)c(C#N)c(-n3c4ccccc4c4ccc5oc6ccccc6c5c43)c2)c(C(F)(F)F)c1.N#Cc1ccc(-c2cc(-n3c4ccccc4c4ccc5sc6ccccc6c5c43)c(C#N)c(-n3c4ccccc4c4ccc5sc6ccccc6c5c43)c2)c(C(F)(F)F)c1.
What is the InChIKey of 2,6-bis([1]benzofuro[2,3-a]carbazol-12-yl)-4-[2-cyano-4-(trifluoromethyl)phenyl]benzonitrile;2,6-bis([1]benzofuro[3,2-a]carbazol-12-yl)-4-[4-cyano-2-(trifluoromethyl)phenyl]benzonitrile;2,6-bis([1]benzothiolo[3,2-a]carbazol-12-yl)-4-[4-cyano-2-(trifluoromethyl)phenyl]benzonitrile;4-[4-cyano-2-(trifluoromethyl)phenyl]-2,6-bis(7H-indeno[1,2-a]carbazol-12-yl)benzonitrile;4-[2-cyano-4-(trifluoromethyl)phenyl]-2-(7H-indeno[1,2-a]carbazol-12-yl)-6-(5H-indolo[3,2-c]carbazol-12-yl)benzonitrile;4-[4-cyano-2-(trifluoromethyl)phenyl]-2-(7H-indeno[1,2-a]carbazol-12-yl)-6-(5H-indolo[3,2-c]carbazol-12-yl)benzonitrile?
The InChIKey is ZEGNXQPXEDKGKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C53H29F3N4.2C52H28F3N5.2C51H25F3N4O2.C51H25F3N4S2/c54-53(55,56)44-23-30(28-57)17-20-36(44)35-26-47(59-45-15-7-5-13-39(45)41-21-18-33-24-31-9-1-3-11-37(31)49(33)51(41)59)43(29-58)48(27-35)60-46-16-8-6-14-40(46)42-22-19-34-25-32-10-2-4-12-38(32)50(34)52(42)60;53-52(54,55)41-23-29(27-56)17-19-33(41)32-25-46(59-44-15-7-4-11-35(44)37-20-18-31-24-30-9-1-2-10-34(30)48(31)50(37)59)40(28-57)47(26-32)60-45-16-8-5-12-36(45)38-21-22-43-49(51(38)60)39-13-3-6-14-42(39)58-43;53-52(54,55)33-18-20-34(32(24-33)27-56)31-25-46(59-44-15-7-4-11-36(44)38-19-17-30-23-29-9-1-2-10-35(29)48(30)50(38)59)41(28-57)47(26-31)60-45-16-8-5-12-37(45)39-21-22-43-49(51(39)60)40-13-3-6-14-42(40)58-43;52-51(53,54)30-17-18-31(29(23-30)26-55)28-24-43(57-41-13-5-1-9-32(41)36-19-21-38-34-11-3-7-15-45(34)59-49(38)47(36)57)40(27-56)44(25-28)58-42-14-6-2-10-33(42)37-20-22-39-35-12-4-8-16-46(35)60-50(39)48(37)58;2*52-51(53,54)38-23-28(26-55)17-18-30(38)29-24-41(57-39-13-5-1-9-31(39)33-19-21-45-47(49(33)57)35-11-3-7-15-43(35)59-45)37(27-56)42(25-29)58-40-14-6-2-10-32(40)34-20-22-46-48(50(34)58)36-12-4-8-16-44(36)60-46/h1-23,26-27H,24-25H2;1-23,25-26,58H,24H2;1-22,24-26,58H,23H2;3*1-25H.
What are the key properties of 2,6-bis([1]benzofuro[2,3-a]carbazol-12-yl)-4-[2-cyano-4-(trifluoromethyl)phenyl]benzonitrile;2,6-bis([1]benzofuro[3,2-a]carbazol-12-yl)-4-[4-cyano-2-(trifluoromethyl)phenyl]benzonitrile;2,6-bis([1]benzothiolo[3,2-a]carbazol-12-yl)-4-[4-cyano-2-(trifluoromethyl)phenyl]benzonitrile;4-[4-cyano-2-(trifluoromethyl)phenyl]-2,6-bis(7H-indeno[1,2-a]carbazol-12-yl)benzonitrile;4-[2-cyano-4-(trifluoromethyl)phenyl]-2-(7H-indeno[1,2-a]carbazol-12-yl)-6-(5H-indolo[3,2-c]carbazol-12-yl)benzonitrile;4-[4-cyano-2-(trifluoromethyl)phenyl]-2-(7H-indeno[1,2-a]carbazol-12-yl)-6-(5H-indolo[3,2-c]carbazol-12-yl)benzonitrile?
2,6-bis([1]benzofuro[2,3-a]carbazol-12-yl)-4-[2-cyano-4-(trifluoromethyl)phenyl]benzonitrile;2,6-bis([1]benzofuro[3,2-a]carbazol-12-yl)-4-[4-cyano-2-(trifluoromethyl)phenyl]benzonitrile;2,6-bis([1]benzothiolo[3,2-a]carbazol-12-yl)-4-[4-cyano-2-(trifluoromethyl)phenyl]benzonitrile;4-[4-cyano-2-(trifluoromethyl)phenyl]-2,6-bis(7H-indeno[1,2-a]carbazol-12-yl)benzonitrile;4-[2-cyano-4-(trifluoromethyl)phenyl]-2-(7H-indeno[1,2-a]carbazol-12-yl)-6-(5H-indolo[3,2-c]carbazol-12-yl)benzonitrile;4-[4-cyano-2-(trifluoromethyl)phenyl]-2-(7H-indeno[1,2-a]carbazol-12-yl)-6-(5H-indolo[3,2-c]carbazol-12-yl)benzonitrile has a molecular weight of 4718.97 g/mol, XLogP of 83.75, 18 rotatable bonds, 2 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-bis([1]benzofuro[2,3-a]carbazol-12-yl)-4-[2-cyano-4-(trifluoromethyl)phenyl]benzonitrile;2,6-bis([1]benzofuro[3,2-a]carbazol-12-yl)-4-[4-cyano-2-(trifluoromethyl)phenyl]benzonitrile;2,6-bis([1]benzothiolo[3,2-a]carbazol-12-yl)-4-[4-cyano-2-(trifluoromethyl)phenyl]benzonitrile;4-[4-cyano-2-(trifluoromethyl)phenyl]-2,6-bis(7H-indeno[1,2-a]carbazol-12-yl)benzonitrile;4-[2-cyano-4-(trifluoromethyl)phenyl]-2-(7H-indeno[1,2-a]carbazol-12-yl)-6-(5H-indolo[3,2-c]carbazol-12-yl)benzonitrile;4-[4-cyano-2-(trifluoromethyl)phenyl]-2-(7H-indeno[1,2-a]carbazol-12-yl)-6-(5H-indolo[3,2-c]carbazol-12-yl)benzonitrile is sourced from PubChem (CID 162096108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).