3,5-bis([1]benzofuro[2,3-b]indol-6-yl)-2,4,6-tris(3-carbazol-9-ylphenyl)benzonitrile;3,5-bis([1]benzothiolo[2,3-b]indol-6-yl)-2,4,6-tris(9-phenylcarbazol-3-yl)benzonitrile;2,4,6-tris(4-carbazol-9-ylphenyl)-3,5-bis[3-(trifluoromethyl)carbazol-9-yl]benzonitrile

C265H154F6N18O2S2 — CID 158255927

IUPAC3,5-bis([1]benzofuro[2,3-b]indol-6-yl)-2,4,6-tris(3-carbazol-9-ylphenyl)benzonitrile;3,5-bis([1]benzothiolo[2,3-b]indol-6-yl)-2,4,6-tris(9-phenylcarbazol-3-yl)benzonitrile;2,4,6-tris(4-carbazol-9-ylphenyl)-3,5-bis[3-(trifluoromethyl)carbazol-9-yl]benzonitrile
SMILESN#Cc1c(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)c(-n2c3ccccc3c3cc(C(F)(F)F)ccc32)c(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)c(-n2c3ccccc3c3cc(C(F)(F)F)ccc32)c1-c1ccc(-n2c3ccccc3c3ccccc32)cc1.N#Cc1c(-c2ccc3c(c2)c2ccccc2n3-c2ccccc2)c(-n2c3ccccc3c3c4ccccc4sc32)c(-c2ccc3c(c2)c2ccccc2n3-c2ccccc2)c(-n2c3ccccc3c3c4ccccc4sc32)c1-c1ccc2c(c1)c1ccccc1n2-c1ccccc1.N#Cc1c(-c2cccc(-n3c4ccccc4c4ccccc43)c2)c(-n2c3ccccc3c3c4ccccc4oc32)c(-c2cccc(-n3c4ccccc4c4ccccc43)c2)c(-n2c3ccccc3c3c4ccccc4oc32)c1-c1cccc(-n2c3ccccc3c3ccccc32)c1
InChIInChI=1S/C89H52N6O2.C89H52N6S2.C87H50F6N6/c90-53-70-81(54-24-21-27-57(50-54)91-71-40-11-1-30-60(71)61-31-2-12-41-72(61)91)86(94-77-46-17-7-36-66(77)84-68-38-9-19-48-79(68)96-88(84)94)83(56-26-23-29-59(52-56)93-75-44-15-5-34-64(75)65-35-6-16-45-76(65)93)87(95-78-47-18-8-37-67(78)85-69-39-10-20-49-80(69)97-89(85)95)82(70)55-25-22-28-58(51-55)92-73-42-13-3-32-62(73)63-33-4-14-43-74(63)92;90-53-70-81(54-44-47-76-67(50-54)60-30-10-17-37-71(60)91(76)57-24-4-1-5-25-57)86(94-74-40-20-13-33-63(74)84-65-35-15-22-42-79(65)96-88(84)94)83(56-46-49-78-69(52-56)62-32-12-19-39-73(62)93(78)59-28-8-3-9-29-59)87(95-75-41-21-14-34-64(75)85-66-36-16-23-43-80(66)97-89(85)95)82(70)55-45-48-77-68(51-55)61-31-11-18-38-72(61)92(77)58-26-6-2-7-27-58;88-86(89,90)55-39-47-79-68(49-55)66-23-7-15-31-77(66)98(79)84-81(52-33-41-57(42-34-52)95-71-25-9-1-17-60(71)61-18-2-10-26-72(61)95)70(51-94)82(53-35-43-58(44-36-53)96-73-27-11-3-19-62(73)63-20-4-12-28-74(63)96)85(99-78-32-16-8-24-67(78)69-50-56(87(91,92)93)40-48-80(69)99)83(84)54-37-45-59(46-38-54)97-75-29-13-5-21-64(75)65-22-6-14-30-76(65)97/h2*1-52H;1-50H
InChIKeyGHHAKSPBQDXITJ-UHFFFAOYSA-N
MW3800.39 g/mol
LogP72.09
Rot. Bonds24

About 3,5-bis([1]benzofuro[2,3-b]indol-6-yl)-2,4,6-tris(3-carbazol-9-ylphenyl)benzonitrile;3,5-bis([1]benzothiolo[2,3-b]indol-6-yl)-2,4,6-tris(9-phenylcarbazol-3-yl)benzonitrile;2,4,6-tris(4-carbazol-9-ylphenyl)-3,5-bis[3-(trifluoromethyl)carbazol-9-yl]benzonitrile

3,5-bis([1]benzofuro[2,3-b]indol-6-yl)-2,4,6-tris(3-carbazol-9-ylphenyl)benzonitrile;3,5-bis([1]benzothiolo[2,3-b]indol-6-yl)-2,4,6-tris(9-phenylcarbazol-3-yl)benzonitrile;2,4,6-tris(4-carbazol-9-ylphenyl)-3,5-bis[3-(trifluoromethyl)carbazol-9-yl]benzonitrile (PubChem CID 158255927) has the molecular formula C265H154F6N18O2S2 and a molecular weight of 3800.39 g/mol. Its IUPAC name is 3,5-bis([1]benzofuro[2,3-b]indol-6-yl)-2,4,6-tris(3-carbazol-9-ylphenyl)benzonitrile;3,5-bis([1]benzothiolo[2,3-b]indol-6-yl)-2,4,6-tris(9-phenylcarbazol-3-yl)benzonitrile;2,4,6-tris(4-carbazol-9-ylphenyl)-3,5-bis[3-(trifluoromethyl)carbazol-9-yl]benzonitrile.

Molecular Properties

Compound Name3,5-bis([1]benzofuro[2,3-b]indol-6-yl)-2,4,6-tris(3-carbazol-9-ylphenyl)benzonitrile;3,5-bis([1]benzothiolo[2,3-b]indol-6-yl)-2,4,6-tris(9-phenylcarbazol-3-yl)benzonitrile;2,4,6-tris(4-carbazol-9-ylphenyl)-3,5-bis[3-(trifluoromethyl)carbazol-9-yl]benzonitrile
PubChem CID158255927
Molecular FormulaC265H154F6N18O2S2
Molecular Weight3800.39 g/mol
Exact Mass3797.18
IUPAC Name3,5-bis([1]benzofuro[2,3-b]indol-6-yl)-2,4,6-tris(3-carbazol-9-ylphenyl)benzonitrile;3,5-bis([1]benzothiolo[2,3-b]indol-6-yl)-2,4,6-tris(9-phenylcarbazol-3-yl)benzonitrile;2,4,6-tris(4-carbazol-9-ylphenyl)-3,5-bis[3-(trifluoromethyl)carbazol-9-yl]benzonitrile
SMILESN#Cc1c(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)c(-n2c3ccccc3c3cc(C(F)(F)F)ccc32)c(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)c(-n2c3ccccc3c3cc(C(F)(F)F)ccc32)c1-c1ccc(-n2c3ccccc3c3ccccc32)cc1.N#Cc1c(-c2ccc3c(c2)c2ccccc2n3-c2ccccc2)c(-n2c3ccccc3c3c4ccccc4sc32)c(-c2ccc3c(c2)c2ccccc2n3-c2ccccc2)c(-n2c3ccccc3c3c4ccccc4sc32)c1-c1ccc2c(c1)c1ccccc1n2-c1ccccc1.N#Cc1c(-c2cccc(-n3c4ccccc4c4ccccc43)c2)c(-n2c3ccccc3c3c4ccccc4oc32)c(-c2cccc(-n3c4ccccc4c4ccccc43)c2)c(-n2c3ccccc3c3c4ccccc4oc32)c1-c1cccc(-n2c3ccccc3c3ccccc32)c1
InChIInChI=1S/C89H52N6O2.C89H52N6S2.C87H50F6N6/c90-53-70-81(54-24-21-27-57(50-54)91-71-40-11-1-30-60(71)61-31-2-12-41-72(61)91)86(94-77-46-17-7-36-66(77)84-68-38-9-19-48-79(68)96-88(84)94)83(56-26-23-29-59(52-56)93-75-44-15-5-34-64(75)65-35-6-16-45-76(65)93)87(95-78-47-18-8-37-67(78)85-69-39-10-20-49-80(69)97-89(85)95)82(70)55-25-22-28-58(51-55)92-73-42-13-3-32-62(73)63-33-4-14-43-74(63)92;90-53-70-81(54-44-47-76-67(50-54)60-30-10-17-37-71(60)91(76)57-24-4-1-5-25-57)86(94-74-40-20-13-33-63(74)84-65-35-15-22-42-79(65)96-88(84)94)83(56-46-49-78-69(52-56)62-32-12-19-39-73(62)93(78)59-28-8-3-9-29-59)87(95-75-41-21-14-34-64(75)85-66-36-16-23-43-80(66)97-89(85)95)82(70)55-45-48-77-68(51-55)61-31-11-18-38-72(61)92(77)58-26-6-2-7-27-58;88-86(89,90)55-39-47-79-68(49-55)66-23-7-15-31-77(66)98(79)84-81(52-33-41-57(42-34-52)95-71-25-9-1-17-60(71)61-18-2-10-26-72(61)95)70(51-94)82(53-35-43-58(44-36-53)96-73-27-11-3-19-62(73)63-20-4-12-28-74(63)96)85(99-78-32-16-8-24-67(78)69-50-56(87(91,92)93)40-48-80(69)99)83(84)54-37-45-59(46-38-54)97-75-29-13-5-21-64(75)65-22-6-14-30-76(65)97/h2*1-52H;1-50H
InChIKeyGHHAKSPBQDXITJ-UHFFFAOYSA-N
XLogP72.09
TPSA171.60 Ų
H-Bond Donors
H-Bond Acceptors22
Rotatable Bonds24
Heavy Atoms293
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003800.39
LogP ≤ 572.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1022

Analyze 3,5-bis([1]benzofuro[2,3-b]indol-6-yl)-2,4,6-tris(3-carbazol-9-ylphenyl)benzonitrile;3,5-bis([1]benzothiolo[2,3-b]indol-6-yl)-2,4,6-tris(9-phenylcarbazol-3-yl)benzonitrile;2,4,6-tris(4-carbazol-9-ylphenyl)-3,5-bis[3-(trifluoromethyl)carbazol-9-yl]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-([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
10-N,22-N-bis(4-fluorophenyl)-26-phenyl-10-N,22-N-bis(6-phenyldibenzofuran-2-yl)-13-thia-1-azaoctacyclo[17.10.1.02,18.03,15.06,14.07,12.023,30.024,29]triaconta-2(18),3(15),4,6(14),7(12),8,10,16,19(30),20,22,24(29),25,27-tetradecaene-10,22-diamine
CID 156374017
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
N-[4-(9-dibenzothiophen-4-ylcarbazol-3-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;8-[3-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]carbazol-9-yl]dibenzofuran-2-carbonitrile;4-phenyl-N-(4-phenylphenyl)-N-[4-[9-[8-(trifluoromethyl)dibenzofuran-2-yl]carbazol-3-yl]phenyl]aniline
CID 157862635
CID 157991336
CID 157991336
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
9-[8-[3-Cyano-6-(trifluoromethyl)carbazol-9-yl]dibenzofuran-2-yl]-6-methylcarbazole-3-carbonitrile;9-dibenzofuran-2-yl-3-(8-dibenzofuran-2-yldibenzofuran-2-yl)-6-isocyanocarbazole;9-[8-(3-dibenzothiophen-2-ylphenyl)dibenzothiophen-2-yl]-6-isocyanocarbazole-3-carbonitrile;3,6-diisocyano-9-(9-phenylcarbazol-3-yl)carbazole
CID 158828017
5-[2-[2-([1]Benzofuro[3,2-c]carbazol-5-yl)-4-isocyanophenyl]-4-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]-[1]benzofuro[3,2-c]carbazole;5-[2-[2-([1]benzothiolo[3,2-c]carbazol-5-yl)-4-isocyanophenyl]-4-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]-[1]benzothiolo[3,2-c]carbazole;4-[5-[2,6-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-[5-isocyano-2-[5-[2-methyl-6-(trifluoromethyl)phenyl]-2-(7-phenylindolo[2,3-b]carbazol-5-yl)phenyl]phenyl]-7-phenylindolo[2,3-b]carbazole;5-[5-isocyano-2-[5-[2-methyl-6-(trifluoromethyl)phenyl]-2-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]phenyl]-12-phenylindolo[3,2-c]carbazole;4-(3-methylcarbazol-9-yl)-3-[2-(3-methylcarbazol-9-yl)-5-[2-methyl-6-(trifluoromethyl)phenyl]phenyl]benzonitrile
CID 158911864
CID 159185752
CID 159185752
5-[2-[2-([1]Benzofuro[3,2-c]carbazol-5-yl)-6-isocyanophenyl]-4-[2-methyl-4-(trifluoromethyl)phenyl]phenyl]-[1]benzofuro[3,2-c]carbazole;5-[2-[2-([1]benzothiolo[3,2-c]carbazol-5-yl)-6-isocyanophenyl]-4-[2-methyl-4-(trifluoromethyl)phenyl]phenyl]-[1]benzothiolo[3,2-c]carbazole;5-[2-[2-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)-6-isocyanophenyl]-4-[2-methyl-4-(trifluoromethyl)phenyl]phenyl]-12,12-dimethylindeno[1,2-c]carbazole;5-[3-isocyano-2-[5-[2-methyl-4-(trifluoromethyl)phenyl]-2-(7-phenylindolo[2,3-b]carbazol-5-yl)phenyl]phenyl]-7-phenylindolo[2,3-b]carbazole;5-[3-isocyano-2-[5-[2-methyl-4-(trifluoromethyl)phenyl]-2-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]phenyl]-12-phenylindolo[3,2-c]carbazole
CID 159416953
3-([1]Benzofuro[3,2-c]carbazol-5-yl)-2-[2-([1]benzofuro[3,2-c]carbazol-5-yl)-6-[2-cyano-4-(trifluoromethyl)phenyl]phenyl]benzonitrile;3-([1]benzothiolo[3,2-c]carbazol-5-yl)-2-[2-([1]benzothiolo[3,2-c]carbazol-5-yl)-6-[2-cyano-4-(trifluoromethyl)phenyl]phenyl]benzonitrile;9-[4-cyano-2-[5-(3-isocyanocarbazol-9-yl)-2-[2-isocyano-4-(trifluoromethyl)phenyl]phenyl]phenyl]carbazole-3-carbonitrile;2-[2-[2-cyano-4-(trifluoromethyl)phenyl]-6-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]-3-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)benzonitrile;5-[3-isocyano-2-[2-[2-isocyano-4-(trifluoromethyl)phenyl]-6-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]phenyl]-12-phenylindolo[3,2-c]carbazole;2-[2-[2-isocyano-6-(7-phenylindolo[2,3-b]carbazol-5-yl)phenyl]-3-(7-phenylindolo[2,3-b]carbazol-5-yl)phenyl]-5-(trifluoromethyl)benzonitrile
CID 159529951
2,6-bis(9-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)-4-[4-cyano-2-(trifluoromethyl)phenyl]benzonitrile;2,6-bis([1]benzofuro[3,2-c]carbazol-5-yl)-4-[2-cyano-4-(trifluoromethyl)phenyl]benzonitrile;2,6-bis([1]benzofuro[3,2-c]carbazol-5-yl)-4-[4-cyano-2-(trifluoromethyl)phenyl]benzonitrile;2,6-bis([1]benzothiolo[3,2-c]carbazol-5-yl)-4-[2-cyano-4-(trifluoromethyl)phenyl]benzonitrile;4-[2-cyano-4-(trifluoromethyl)phenyl]-2,6-bis(12H-indeno[1,2-c]carbazol-5-yl)benzonitrile;4-[2-cyano-4-(trifluoromethyl)phenyl]-2,6-bis(12H-indolo[3,2-c]carbazol-5-yl)benzonitrile
CID 159811024

Frequently Asked Questions

What is the IUPAC name of 3,5-bis([1]benzofuro[2,3-b]indol-6-yl)-2,4,6-tris(3-carbazol-9-ylphenyl)benzonitrile;3,5-bis([1]benzothiolo[2,3-b]indol-6-yl)-2,4,6-tris(9-phenylcarbazol-3-yl)benzonitrile;2,4,6-tris(4-carbazol-9-ylphenyl)-3,5-bis[3-(trifluoromethyl)carbazol-9-yl]benzonitrile?
The IUPAC name of 3,5-bis([1]benzofuro[2,3-b]indol-6-yl)-2,4,6-tris(3-carbazol-9-ylphenyl)benzonitrile;3,5-bis([1]benzothiolo[2,3-b]indol-6-yl)-2,4,6-tris(9-phenylcarbazol-3-yl)benzonitrile;2,4,6-tris(4-carbazol-9-ylphenyl)-3,5-bis[3-(trifluoromethyl)carbazol-9-yl]benzonitrile (CID 158255927) is 3,5-bis([1]benzofuro[2,3-b]indol-6-yl)-2,4,6-tris(3-carbazol-9-ylphenyl)benzonitrile;3,5-bis([1]benzothiolo[2,3-b]indol-6-yl)-2,4,6-tris(9-phenylcarbazol-3-yl)benzonitrile;2,4,6-tris(4-carbazol-9-ylphenyl)-3,5-bis[3-(trifluoromethyl)carbazol-9-yl]benzonitrile.
What is the SMILES notation for 3,5-bis([1]benzofuro[2,3-b]indol-6-yl)-2,4,6-tris(3-carbazol-9-ylphenyl)benzonitrile;3,5-bis([1]benzothiolo[2,3-b]indol-6-yl)-2,4,6-tris(9-phenylcarbazol-3-yl)benzonitrile;2,4,6-tris(4-carbazol-9-ylphenyl)-3,5-bis[3-(trifluoromethyl)carbazol-9-yl]benzonitrile?
The canonical SMILES for 3,5-bis([1]benzofuro[2,3-b]indol-6-yl)-2,4,6-tris(3-carbazol-9-ylphenyl)benzonitrile;3,5-bis([1]benzothiolo[2,3-b]indol-6-yl)-2,4,6-tris(9-phenylcarbazol-3-yl)benzonitrile;2,4,6-tris(4-carbazol-9-ylphenyl)-3,5-bis[3-(trifluoromethyl)carbazol-9-yl]benzonitrile is N#Cc1c(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)c(-n2c3ccccc3c3cc(C(F)(F)F)ccc32)c(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)c(-n2c3ccccc3c3cc(C(F)(F)F)ccc32)c1-c1ccc(-n2c3ccccc3c3ccccc32)cc1.N#Cc1c(-c2ccc3c(c2)c2ccccc2n3-c2ccccc2)c(-n2c3ccccc3c3c4ccccc4sc32)c(-c2ccc3c(c2)c2ccccc2n3-c2ccccc2)c(-n2c3ccccc3c3c4ccccc4sc32)c1-c1ccc2c(c1)c1ccccc1n2-c1ccccc1.N#Cc1c(-c2cccc(-n3c4ccccc4c4ccccc43)c2)c(-n2c3ccccc3c3c4ccccc4oc32)c(-c2cccc(-n3c4ccccc4c4ccccc43)c2)c(-n2c3ccccc3c3c4ccccc4oc32)c1-c1cccc(-n2c3ccccc3c3ccccc32)c1.
What is the InChIKey of 3,5-bis([1]benzofuro[2,3-b]indol-6-yl)-2,4,6-tris(3-carbazol-9-ylphenyl)benzonitrile;3,5-bis([1]benzothiolo[2,3-b]indol-6-yl)-2,4,6-tris(9-phenylcarbazol-3-yl)benzonitrile;2,4,6-tris(4-carbazol-9-ylphenyl)-3,5-bis[3-(trifluoromethyl)carbazol-9-yl]benzonitrile?
The InChIKey is GHHAKSPBQDXITJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C89H52N6O2.C89H52N6S2.C87H50F6N6/c90-53-70-81(54-24-21-27-57(50-54)91-71-40-11-1-30-60(71)61-31-2-12-41-72(61)91)86(94-77-46-17-7-36-66(77)84-68-38-9-19-48-79(68)96-88(84)94)83(56-26-23-29-59(52-56)93-75-44-15-5-34-64(75)65-35-6-16-45-76(65)93)87(95-78-47-18-8-37-67(78)85-69-39-10-20-49-80(69)97-89(85)95)82(70)55-25-22-28-58(51-55)92-73-42-13-3-32-62(73)63-33-4-14-43-74(63)92;90-53-70-81(54-44-47-76-67(50-54)60-30-10-17-37-71(60)91(76)57-24-4-1-5-25-57)86(94-74-40-20-13-33-63(74)84-65-35-15-22-42-79(65)96-88(84)94)83(56-46-49-78-69(52-56)62-32-12-19-39-73(62)93(78)59-28-8-3-9-29-59)87(95-75-41-21-14-34-64(75)85-66-36-16-23-43-80(66)97-89(85)95)82(70)55-45-48-77-68(51-55)61-31-11-18-38-72(61)92(77)58-26-6-2-7-27-58;88-86(89,90)55-39-47-79-68(49-55)66-23-7-15-31-77(66)98(79)84-81(52-33-41-57(42-34-52)95-71-25-9-1-17-60(71)61-18-2-10-26-72(61)95)70(51-94)82(53-35-43-58(44-36-53)96-73-27-11-3-19-62(73)63-20-4-12-28-74(63)96)85(99-78-32-16-8-24-67(78)69-50-56(87(91,92)93)40-48-80(69)99)83(84)54-37-45-59(46-38-54)97-75-29-13-5-21-64(75)65-22-6-14-30-76(65)97/h2*1-52H;1-50H.
What are the key properties of 3,5-bis([1]benzofuro[2,3-b]indol-6-yl)-2,4,6-tris(3-carbazol-9-ylphenyl)benzonitrile;3,5-bis([1]benzothiolo[2,3-b]indol-6-yl)-2,4,6-tris(9-phenylcarbazol-3-yl)benzonitrile;2,4,6-tris(4-carbazol-9-ylphenyl)-3,5-bis[3-(trifluoromethyl)carbazol-9-yl]benzonitrile?
3,5-bis([1]benzofuro[2,3-b]indol-6-yl)-2,4,6-tris(3-carbazol-9-ylphenyl)benzonitrile;3,5-bis([1]benzothiolo[2,3-b]indol-6-yl)-2,4,6-tris(9-phenylcarbazol-3-yl)benzonitrile;2,4,6-tris(4-carbazol-9-ylphenyl)-3,5-bis[3-(trifluoromethyl)carbazol-9-yl]benzonitrile has a molecular weight of 3800.39 g/mol, XLogP of 72.09, 24 rotatable bonds, 0 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-bis([1]benzofuro[2,3-b]indol-6-yl)-2,4,6-tris(3-carbazol-9-ylphenyl)benzonitrile;3,5-bis([1]benzothiolo[2,3-b]indol-6-yl)-2,4,6-tris(9-phenylcarbazol-3-yl)benzonitrile;2,4,6-tris(4-carbazol-9-ylphenyl)-3,5-bis[3-(trifluoromethyl)carbazol-9-yl]benzonitrile is sourced from PubChem (CID 158255927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).