4-([1]benzofuro[3,2-c]carbazol-5-yl)-3-[5-([1]benzofuro[3,2-c]carbazol-5-yl)-2-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]benzonitrile;4-[9-[2-[5-[3,6-bis(2,4-diisocyanophenyl)carbazol-9-yl]-2-[3,5-bis(trifluoromethyl)phenyl]phenyl]-4-cyanophenyl]-6-(2-cyano-4-isocyanophenyl)carbazol-3-yl]benzene-1,3-dicarbonitrile;4-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-3-[5-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-2-[3,5-bis(trifluoromethyl)phenyl]phenyl]benzonitrile;3-(4,6-dimethyl-1,3,5-triazin-2-yl)-9-[3-[2-[3-(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-5-isocyanophenyl]-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole

C254H148F18N38O2 — CID 159372870

IUPAC4-([1]benzofuro[3,2-c]carbazol-5-yl)-3-[5-([1]benzofuro[3,2-c]carbazol-5-yl)-2-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]benzonitrile;4-[9-[2-[5-[3,6-bis(2,4-diisocyanophenyl)carbazol-9-yl]-2-[3,5-bis(trifluoromethyl)phenyl]phenyl]-4-cyanophenyl]-6-(2-cyano-4-isocyanophenyl)carbazol-3-yl]benzene-1,3-dicarbonitrile;4-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-3-[5-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-2-[3,5-bis(trifluoromethyl)phenyl]phenyl]benzonitrile;3-(4,6-dimethyl-1,3,5-triazin-2-yl)-9-[3-[2-[3-(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-5-isocyanophenyl]-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole
SMILESCc1cc(-c2ccc(-n3c4ccccc4c4c5oc6ccccc6c5ccc43)cc2-c2cc(C#N)ccc2-n2c3ccccc3c3c4oc5ccccc5c4ccc32)cc(C(F)(F)F)c1.Cc1nc(C)nc(-c2ccc3c(c2)c2cc(-c4nc(C)nc(C)n4)ccc2n3-c2ccc(-c3cc(C(F)(F)F)cc(C(F)(F)F)c3)c(-c3cc(C#N)ccc3-n3c4ccc(-c5nc(C)nc(C)n5)cc4c4cc(-c5nc(C)nc(C)n5)ccc43)c2)n1.[C-]#[N+]c1ccc(-c2ccc3c(c2)c2cc(-c4ccc(C#N)cc4C#N)ccc2n3-c2ccc(C#N)cc2-c2cc(-n3c4ccc(-c5ccc([N+]#[C-])cc5[N+]#[C-])cc4c4cc(-c5ccc([N+]#[C-])cc5[N+]#[C-])ccc43)ccc2-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c(C#N)c1.[C-]#[N+]c1ccc(-n2c3ccccc3c3cc(-c4nc(C)nc(C)n4)ccc32)c(-c2cc(-n3c4ccccc4c4cc(-c5nc(C)nc(C)n5)ccc43)ccc2-c2cc(C)cc(C(F)(F)F)c2)c1
InChIInChI=1S/C77H33F6N11.C65H45F6N15.C57H32F3N3O2.C55H38F3N9/c1-88-54-12-17-59(51(30-54)42-87)46-9-25-75-68(32-46)67-31-45(58-16-6-43(39-84)26-50(58)41-86)8-24-74(67)94(75)73-21-7-44(40-85)27-64(73)63-38-57(15-20-60(63)49-28-52(76(78,79)80)35-53(29-49)77(81,82)83)93-71-22-10-47(61-18-13-55(89-2)36-69(61)91-4)33-65(71)66-34-48(11-23-72(66)93)62-19-14-56(90-3)37-70(62)92-5;1-31-73-32(2)78-60(77-31)40-10-17-55-51(24-40)52-25-41(61-79-33(3)74-34(4)80-61)11-18-56(52)85(55)47-14-15-48(44-22-45(64(66,67)68)28-46(23-44)65(69,70)71)49(29-47)50-21-39(30-72)9-16-57(50)86-58-19-12-42(62-81-35(5)75-36(6)82-62)26-53(58)54-27-43(13-20-59(54)86)63-83-37(7)76-38(8)84-63;1-32-26-34(29-35(27-32)57(58,59)60)37-20-19-36(62-46-14-6-2-12-42(46)53-49(62)24-21-40-38-10-4-8-16-51(38)64-55(40)53)30-44(37)45-28-33(31-61)18-23-48(45)63-47-15-7-3-13-43(47)54-50(63)25-22-41-39-11-5-9-17-52(39)65-56(41)54;1-30-23-37(25-38(24-30)55(56,57)58)41-19-18-40(66-48-13-9-7-11-42(48)45-26-35(15-20-50(45)66)53-62-31(2)60-32(3)63-53)29-44(41)47-28-39(59-6)17-22-52(47)67-49-14-10-8-12-43(49)46-27-36(16-21-51(46)67)54-64-33(4)61-34(5)65-54/h6-38H;9-29H,1-8H3;2-30H,1H3;7-29H,1-5H3
InChIKeyLJYMXBONTOUDSW-UHFFFAOYSA-N
MW4106.21 g/mol
LogP67.40
Rot. Bonds26

About 4-([1]benzofuro[3,2-c]carbazol-5-yl)-3-[5-([1]benzofuro[3,2-c]carbazol-5-yl)-2-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]benzonitrile;4-[9-[2-[5-[3,6-bis(2,4-diisocyanophenyl)carbazol-9-yl]-2-[3,5-bis(trifluoromethyl)phenyl]phenyl]-4-cyanophenyl]-6-(2-cyano-4-isocyanophenyl)carbazol-3-yl]benzene-1,3-dicarbonitrile;4-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-3-[5-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-2-[3,5-bis(trifluoromethyl)phenyl]phenyl]benzonitrile;3-(4,6-dimethyl-1,3,5-triazin-2-yl)-9-[3-[2-[3-(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-5-isocyanophenyl]-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole

4-([1]benzofuro[3,2-c]carbazol-5-yl)-3-[5-([1]benzofuro[3,2-c]carbazol-5-yl)-2-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]benzonitrile;4-[9-[2-[5-[3,6-bis(2,4-diisocyanophenyl)carbazol-9-yl]-2-[3,5-bis(trifluoromethyl)phenyl]phenyl]-4-cyanophenyl]-6-(2-cyano-4-isocyanophenyl)carbazol-3-yl]benzene-1,3-dicarbonitrile;4-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-3-[5-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-2-[3,5-bis(trifluoromethyl)phenyl]phenyl]benzonitrile;3-(4,6-dimethyl-1,3,5-triazin-2-yl)-9-[3-[2-[3-(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-5-isocyanophenyl]-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole (PubChem CID 159372870) has the molecular formula C254H148F18N38O2 and a molecular weight of 4106.21 g/mol. Its IUPAC name is 4-([1]benzofuro[3,2-c]carbazol-5-yl)-3-[5-([1]benzofuro[3,2-c]carbazol-5-yl)-2-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]benzonitrile;4-[9-[2-[5-[3,6-bis(2,4-diisocyanophenyl)carbazol-9-yl]-2-[3,5-bis(trifluoromethyl)phenyl]phenyl]-4-cyanophenyl]-6-(2-cyano-4-isocyanophenyl)carbazol-3-yl]benzene-1,3-dicarbonitrile;4-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-3-[5-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-2-[3,5-bis(trifluoromethyl)phenyl]phenyl]benzonitrile;3-(4,6-dimethyl-1,3,5-triazin-2-yl)-9-[3-[2-[3-(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-5-isocyanophenyl]-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole.

Molecular Properties

Compound Name4-([1]benzofuro[3,2-c]carbazol-5-yl)-3-[5-([1]benzofuro[3,2-c]carbazol-5-yl)-2-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]benzonitrile;4-[9-[2-[5-[3,6-bis(2,4-diisocyanophenyl)carbazol-9-yl]-2-[3,5-bis(trifluoromethyl)phenyl]phenyl]-4-cyanophenyl]-6-(2-cyano-4-isocyanophenyl)carbazol-3-yl]benzene-1,3-dicarbonitrile;4-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-3-[5-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-2-[3,5-bis(trifluoromethyl)phenyl]phenyl]benzonitrile;3-(4,6-dimethyl-1,3,5-triazin-2-yl)-9-[3-[2-[3-(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-5-isocyanophenyl]-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole
PubChem CID159372870
Molecular FormulaC254H148F18N38O2
Molecular Weight4106.21 g/mol
Exact Mass4103.24
IUPAC Name4-([1]benzofuro[3,2-c]carbazol-5-yl)-3-[5-([1]benzofuro[3,2-c]carbazol-5-yl)-2-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]benzonitrile;4-[9-[2-[5-[3,6-bis(2,4-diisocyanophenyl)carbazol-9-yl]-2-[3,5-bis(trifluoromethyl)phenyl]phenyl]-4-cyanophenyl]-6-(2-cyano-4-isocyanophenyl)carbazol-3-yl]benzene-1,3-dicarbonitrile;4-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-3-[5-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-2-[3,5-bis(trifluoromethyl)phenyl]phenyl]benzonitrile;3-(4,6-dimethyl-1,3,5-triazin-2-yl)-9-[3-[2-[3-(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-5-isocyanophenyl]-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole
SMILESCc1cc(-c2ccc(-n3c4ccccc4c4c5oc6ccccc6c5ccc43)cc2-c2cc(C#N)ccc2-n2c3ccccc3c3c4oc5ccccc5c4ccc32)cc(C(F)(F)F)c1.Cc1nc(C)nc(-c2ccc3c(c2)c2cc(-c4nc(C)nc(C)n4)ccc2n3-c2ccc(-c3cc(C(F)(F)F)cc(C(F)(F)F)c3)c(-c3cc(C#N)ccc3-n3c4ccc(-c5nc(C)nc(C)n5)cc4c4cc(-c5nc(C)nc(C)n5)ccc43)c2)n1.[C-]#[N+]c1ccc(-c2ccc3c(c2)c2cc(-c4ccc(C#N)cc4C#N)ccc2n3-c2ccc(C#N)cc2-c2cc(-n3c4ccc(-c5ccc([N+]#[C-])cc5[N+]#[C-])cc4c4cc(-c5ccc([N+]#[C-])cc5[N+]#[C-])ccc43)ccc2-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c(C#N)c1.[C-]#[N+]c1ccc(-n2c3ccccc3c3cc(-c4nc(C)nc(C)n4)ccc32)c(-c2cc(-n3c4ccccc4c4cc(-c5nc(C)nc(C)n5)ccc43)ccc2-c2cc(C)cc(C(F)(F)F)c2)c1
InChIInChI=1S/C77H33F6N11.C65H45F6N15.C57H32F3N3O2.C55H38F3N9/c1-88-54-12-17-59(51(30-54)42-87)46-9-25-75-68(32-46)67-31-45(58-16-6-43(39-84)26-50(58)41-86)8-24-74(67)94(75)73-21-7-44(40-85)27-64(73)63-38-57(15-20-60(63)49-28-52(76(78,79)80)35-53(29-49)77(81,82)83)93-71-22-10-47(61-18-13-55(89-2)36-69(61)91-4)33-65(71)66-34-48(11-23-72(66)93)62-19-14-56(90-3)37-70(62)92-5;1-31-73-32(2)78-60(77-31)40-10-17-55-51(24-40)52-25-41(61-79-33(3)74-34(4)80-61)11-18-56(52)85(55)47-14-15-48(44-22-45(64(66,67)68)28-46(23-44)65(69,70)71)49(29-47)50-21-39(30-72)9-16-57(50)86-58-19-12-42(62-81-35(5)75-36(6)82-62)26-53(58)54-27-43(13-20-59(54)86)63-83-37(7)76-38(8)84-63;1-32-26-34(29-35(27-32)57(58,59)60)37-20-19-36(62-46-14-6-2-12-42(46)53-49(62)24-21-40-38-10-4-8-16-51(38)64-55(40)53)30-44(37)45-28-33(31-61)18-23-48(45)63-47-15-7-3-13-43(47)54-50(63)25-22-41-39-11-5-9-17-52(39)65-56(41)54;1-30-23-37(25-38(24-30)55(56,57)58)41-19-18-40(66-48-13-9-7-11-42(48)45-26-35(15-20-50(45)66)53-62-31(2)60-32(3)63-53)29-44(41)47-28-39(59-6)17-22-52(47)67-49-14-10-8-12-43(49)46-27-36(16-21-51(46)67)54-64-33(4)61-34(5)65-54/h6-38H;9-29H,1-8H3;2-30H,1H3;7-29H,1-5H3
InChIKeyLJYMXBONTOUDSW-UHFFFAOYSA-N
XLogP67.40
TPSA466.64 Ų
H-Bond Donors
H-Bond Acceptors34
Rotatable Bonds26
Heavy Atoms312
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004106.21
LogP ≤ 567.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1034

Analyze 4-([1]benzofuro[3,2-c]carbazol-5-yl)-3-[5-([1]benzofuro[3,2-c]carbazol-5-yl)-2-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]benzonitrile;4-[9-[2-[5-[3,6-bis(2,4-diisocyanophenyl)carbazol-9-yl]-2-[3,5-bis(trifluoromethyl)phenyl]phenyl]-4-cyanophenyl]-6-(2-cyano-4-isocyanophenyl)carbazol-3-yl]benzene-1,3-dicarbonitrile;4-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-3-[5-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-2-[3,5-bis(trifluoromethyl)phenyl]phenyl]benzonitrile;3-(4,6-dimethyl-1,3,5-triazin-2-yl)-9-[3-[2-[3-(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-5-isocyanophenyl]-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-([1]benzofuro[3,2-c]carbazol-5-yl)-3-[5-([1]benzofuro[3,2-c]carbazol-5-yl)-2-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]benzonitrile;4-[9-[2-[5-[3,6-bis(2,4-diisocyanophenyl)carbazol-9-yl]-2-[3,5-bis(trifluoromethyl)phenyl]phenyl]-4-cyanophenyl]-6-(2-cyano-4-isocyanophenyl)carbazol-3-yl]benzene-1,3-dicarbonitrile;4-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-3-[5-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-2-[3,5-bis(trifluoromethyl)phenyl]phenyl]benzonitrile;3-(4,6-dimethyl-1,3,5-triazin-2-yl)-9-[3-[2-[3-(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-5-isocyanophenyl]-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole?
The IUPAC name of 4-([1]benzofuro[3,2-c]carbazol-5-yl)-3-[5-([1]benzofuro[3,2-c]carbazol-5-yl)-2-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]benzonitrile;4-[9-[2-[5-[3,6-bis(2,4-diisocyanophenyl)carbazol-9-yl]-2-[3,5-bis(trifluoromethyl)phenyl]phenyl]-4-cyanophenyl]-6-(2-cyano-4-isocyanophenyl)carbazol-3-yl]benzene-1,3-dicarbonitrile;4-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-3-[5-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-2-[3,5-bis(trifluoromethyl)phenyl]phenyl]benzonitrile;3-(4,6-dimethyl-1,3,5-triazin-2-yl)-9-[3-[2-[3-(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-5-isocyanophenyl]-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole (CID 159372870) is 4-([1]benzofuro[3,2-c]carbazol-5-yl)-3-[5-([1]benzofuro[3,2-c]carbazol-5-yl)-2-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]benzonitrile;4-[9-[2-[5-[3,6-bis(2,4-diisocyanophenyl)carbazol-9-yl]-2-[3,5-bis(trifluoromethyl)phenyl]phenyl]-4-cyanophenyl]-6-(2-cyano-4-isocyanophenyl)carbazol-3-yl]benzene-1,3-dicarbonitrile;4-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-3-[5-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-2-[3,5-bis(trifluoromethyl)phenyl]phenyl]benzonitrile;3-(4,6-dimethyl-1,3,5-triazin-2-yl)-9-[3-[2-[3-(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-5-isocyanophenyl]-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole.
What is the SMILES notation for 4-([1]benzofuro[3,2-c]carbazol-5-yl)-3-[5-([1]benzofuro[3,2-c]carbazol-5-yl)-2-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]benzonitrile;4-[9-[2-[5-[3,6-bis(2,4-diisocyanophenyl)carbazol-9-yl]-2-[3,5-bis(trifluoromethyl)phenyl]phenyl]-4-cyanophenyl]-6-(2-cyano-4-isocyanophenyl)carbazol-3-yl]benzene-1,3-dicarbonitrile;4-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-3-[5-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-2-[3,5-bis(trifluoromethyl)phenyl]phenyl]benzonitrile;3-(4,6-dimethyl-1,3,5-triazin-2-yl)-9-[3-[2-[3-(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-5-isocyanophenyl]-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole?
The canonical SMILES for 4-([1]benzofuro[3,2-c]carbazol-5-yl)-3-[5-([1]benzofuro[3,2-c]carbazol-5-yl)-2-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]benzonitrile;4-[9-[2-[5-[3,6-bis(2,4-diisocyanophenyl)carbazol-9-yl]-2-[3,5-bis(trifluoromethyl)phenyl]phenyl]-4-cyanophenyl]-6-(2-cyano-4-isocyanophenyl)carbazol-3-yl]benzene-1,3-dicarbonitrile;4-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-3-[5-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-2-[3,5-bis(trifluoromethyl)phenyl]phenyl]benzonitrile;3-(4,6-dimethyl-1,3,5-triazin-2-yl)-9-[3-[2-[3-(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-5-isocyanophenyl]-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole is Cc1cc(-c2ccc(-n3c4ccccc4c4c5oc6ccccc6c5ccc43)cc2-c2cc(C#N)ccc2-n2c3ccccc3c3c4oc5ccccc5c4ccc32)cc(C(F)(F)F)c1.Cc1nc(C)nc(-c2ccc3c(c2)c2cc(-c4nc(C)nc(C)n4)ccc2n3-c2ccc(-c3cc(C(F)(F)F)cc(C(F)(F)F)c3)c(-c3cc(C#N)ccc3-n3c4ccc(-c5nc(C)nc(C)n5)cc4c4cc(-c5nc(C)nc(C)n5)ccc43)c2)n1.[C-]#[N+]c1ccc(-c2ccc3c(c2)c2cc(-c4ccc(C#N)cc4C#N)ccc2n3-c2ccc(C#N)cc2-c2cc(-n3c4ccc(-c5ccc([N+]#[C-])cc5[N+]#[C-])cc4c4cc(-c5ccc([N+]#[C-])cc5[N+]#[C-])ccc43)ccc2-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c(C#N)c1.[C-]#[N+]c1ccc(-n2c3ccccc3c3cc(-c4nc(C)nc(C)n4)ccc32)c(-c2cc(-n3c4ccccc4c4cc(-c5nc(C)nc(C)n5)ccc43)ccc2-c2cc(C)cc(C(F)(F)F)c2)c1.
What is the InChIKey of 4-([1]benzofuro[3,2-c]carbazol-5-yl)-3-[5-([1]benzofuro[3,2-c]carbazol-5-yl)-2-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]benzonitrile;4-[9-[2-[5-[3,6-bis(2,4-diisocyanophenyl)carbazol-9-yl]-2-[3,5-bis(trifluoromethyl)phenyl]phenyl]-4-cyanophenyl]-6-(2-cyano-4-isocyanophenyl)carbazol-3-yl]benzene-1,3-dicarbonitrile;4-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-3-[5-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-2-[3,5-bis(trifluoromethyl)phenyl]phenyl]benzonitrile;3-(4,6-dimethyl-1,3,5-triazin-2-yl)-9-[3-[2-[3-(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-5-isocyanophenyl]-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole?
The InChIKey is LJYMXBONTOUDSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C77H33F6N11.C65H45F6N15.C57H32F3N3O2.C55H38F3N9/c1-88-54-12-17-59(51(30-54)42-87)46-9-25-75-68(32-46)67-31-45(58-16-6-43(39-84)26-50(58)41-86)8-24-74(67)94(75)73-21-7-44(40-85)27-64(73)63-38-57(15-20-60(63)49-28-52(76(78,79)80)35-53(29-49)77(81,82)83)93-71-22-10-47(61-18-13-55(89-2)36-69(61)91-4)33-65(71)66-34-48(11-23-72(66)93)62-19-14-56(90-3)37-70(62)92-5;1-31-73-32(2)78-60(77-31)40-10-17-55-51(24-40)52-25-41(61-79-33(3)74-34(4)80-61)11-18-56(52)85(55)47-14-15-48(44-22-45(64(66,67)68)28-46(23-44)65(69,70)71)49(29-47)50-21-39(30-72)9-16-57(50)86-58-19-12-42(62-81-35(5)75-36(6)82-62)26-53(58)54-27-43(13-20-59(54)86)63-83-37(7)76-38(8)84-63;1-32-26-34(29-35(27-32)57(58,59)60)37-20-19-36(62-46-14-6-2-12-42(46)53-49(62)24-21-40-38-10-4-8-16-51(38)64-55(40)53)30-44(37)45-28-33(31-61)18-23-48(45)63-47-15-7-3-13-43(47)54-50(63)25-22-41-39-11-5-9-17-52(39)65-56(41)54;1-30-23-37(25-38(24-30)55(56,57)58)41-19-18-40(66-48-13-9-7-11-42(48)45-26-35(15-20-50(45)66)53-62-31(2)60-32(3)63-53)29-44(41)47-28-39(59-6)17-22-52(47)67-49-14-10-8-12-43(49)46-27-36(16-21-51(46)67)54-64-33(4)61-34(5)65-54/h6-38H;9-29H,1-8H3;2-30H,1H3;7-29H,1-5H3.
What are the key properties of 4-([1]benzofuro[3,2-c]carbazol-5-yl)-3-[5-([1]benzofuro[3,2-c]carbazol-5-yl)-2-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]benzonitrile;4-[9-[2-[5-[3,6-bis(2,4-diisocyanophenyl)carbazol-9-yl]-2-[3,5-bis(trifluoromethyl)phenyl]phenyl]-4-cyanophenyl]-6-(2-cyano-4-isocyanophenyl)carbazol-3-yl]benzene-1,3-dicarbonitrile;4-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-3-[5-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-2-[3,5-bis(trifluoromethyl)phenyl]phenyl]benzonitrile;3-(4,6-dimethyl-1,3,5-triazin-2-yl)-9-[3-[2-[3-(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-5-isocyanophenyl]-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole?
4-([1]benzofuro[3,2-c]carbazol-5-yl)-3-[5-([1]benzofuro[3,2-c]carbazol-5-yl)-2-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]benzonitrile;4-[9-[2-[5-[3,6-bis(2,4-diisocyanophenyl)carbazol-9-yl]-2-[3,5-bis(trifluoromethyl)phenyl]phenyl]-4-cyanophenyl]-6-(2-cyano-4-isocyanophenyl)carbazol-3-yl]benzene-1,3-dicarbonitrile;4-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-3-[5-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-2-[3,5-bis(trifluoromethyl)phenyl]phenyl]benzonitrile;3-(4,6-dimethyl-1,3,5-triazin-2-yl)-9-[3-[2-[3-(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-5-isocyanophenyl]-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole has a molecular weight of 4106.21 g/mol, XLogP of 67.40, 26 rotatable bonds, 0 hydrogen bond donors, and 34 hydrogen bond acceptors.
Where does this data come from?
All data for 4-([1]benzofuro[3,2-c]carbazol-5-yl)-3-[5-([1]benzofuro[3,2-c]carbazol-5-yl)-2-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]benzonitrile;4-[9-[2-[5-[3,6-bis(2,4-diisocyanophenyl)carbazol-9-yl]-2-[3,5-bis(trifluoromethyl)phenyl]phenyl]-4-cyanophenyl]-6-(2-cyano-4-isocyanophenyl)carbazol-3-yl]benzene-1,3-dicarbonitrile;4-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-3-[5-[3,6-bis(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-2-[3,5-bis(trifluoromethyl)phenyl]phenyl]benzonitrile;3-(4,6-dimethyl-1,3,5-triazin-2-yl)-9-[3-[2-[3-(4,6-dimethyl-1,3,5-triazin-2-yl)carbazol-9-yl]-5-isocyanophenyl]-4-[3-methyl-5-(trifluoromethyl)phenyl]phenyl]carbazole is sourced from PubChem (CID 159372870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).