2-[3-([1]benzofuro[2,3-b]carbazol-7-yl)-5-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-4-phenylbenzene-1,3-dicarbonitrile;2-[3-([1]benzofuro[3,2-c]carbazol-5-yl)-5-dibenzofuran-2-ylphenyl]-4-(4-cyanophenyl)benzonitrile;2-[3-[3-([1]benzofuro[3,2-c]carbazol-5-yl)-5-dibenzofuran-2-ylphenyl]phenyl]benzene-1,3-dicarbonitrile

C162H89N11O5 — CID 159299264

IUPAC2-[3-([1]benzofuro[2,3-b]carbazol-7-yl)-5-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-4-phenylbenzene-1,3-dicarbonitrile;2-[3-([1]benzofuro[3,2-c]carbazol-5-yl)-5-dibenzofuran-2-ylphenyl]-4-(4-cyanophenyl)benzonitrile;2-[3-[3-([1]benzofuro[3,2-c]carbazol-5-yl)-5-dibenzofuran-2-ylphenyl]phenyl]benzene-1,3-dicarbonitrile
SMILESN#Cc1ccc(-c2ccc(C#N)c(-c3cc(-c4ccc5oc6ccccc6c5c4)cc(-n4c5ccccc5c5c6oc7ccccc7c6ccc54)c3)c2)cc1.N#Cc1ccc(-c2ccccc2)c(C#N)c1-c1cc(-n2c3ccccc3c3cc4c(cc32)oc2ccccc24)cc(-n2c3ccccc3c3c2ccc2c4ccccc4n(-c4ccccc4)c23)c1.N#Cc1cccc(C#N)c1-c1cccc(-c2cc(-c3ccc4oc5ccccc5c4c3)cc(-n3c4ccccc4c4c5oc6ccccc6c5ccc43)c2)c1
InChIInChI=1S/C62H35N5O.2C50H27N3O2/c63-36-39-27-28-44(38-15-3-1-4-16-38)52(37-64)60(39)40-31-42(33-43(32-40)66-53-23-11-8-20-46(53)50-34-51-47-21-10-14-26-58(47)68-59(51)35-57(50)66)65-55-25-13-9-22-49(55)61-56(65)30-29-48-45-19-7-12-24-54(45)67(62(48)61)41-17-5-2-6-18-41;51-28-33-11-8-12-34(29-52)48(33)32-10-7-9-30(23-32)35-24-36(31-19-22-47-42(27-31)39-14-3-5-17-45(39)54-47)26-37(25-35)53-43-16-4-1-15-41(43)49-44(53)21-20-40-38-13-2-6-18-46(38)55-50(40)49;51-28-30-13-15-31(16-14-30)32-17-18-34(29-52)42(26-32)36-23-35(33-19-22-48-43(27-33)39-8-3-5-11-46(39)54-48)24-37(25-36)53-44-10-4-1-9-41(44)49-45(53)21-20-40-38-7-2-6-12-47(38)55-50(40)49/h1-35H;2*1-27H
InChIKeyLBCSRUSONVXLBJ-UHFFFAOYSA-N
MW2269.57 g/mol
LogP42.61
Rot. Bonds13

About 2-[3-([1]benzofuro[2,3-b]carbazol-7-yl)-5-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-4-phenylbenzene-1,3-dicarbonitrile;2-[3-([1]benzofuro[3,2-c]carbazol-5-yl)-5-dibenzofuran-2-ylphenyl]-4-(4-cyanophenyl)benzonitrile;2-[3-[3-([1]benzofuro[3,2-c]carbazol-5-yl)-5-dibenzofuran-2-ylphenyl]phenyl]benzene-1,3-dicarbonitrile

2-[3-([1]benzofuro[2,3-b]carbazol-7-yl)-5-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-4-phenylbenzene-1,3-dicarbonitrile;2-[3-([1]benzofuro[3,2-c]carbazol-5-yl)-5-dibenzofuran-2-ylphenyl]-4-(4-cyanophenyl)benzonitrile;2-[3-[3-([1]benzofuro[3,2-c]carbazol-5-yl)-5-dibenzofuran-2-ylphenyl]phenyl]benzene-1,3-dicarbonitrile (PubChem CID 159299264) has the molecular formula C162H89N11O5 and a molecular weight of 2269.57 g/mol. Its IUPAC name is 2-[3-([1]benzofuro[2,3-b]carbazol-7-yl)-5-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-4-phenylbenzene-1,3-dicarbonitrile;2-[3-([1]benzofuro[3,2-c]carbazol-5-yl)-5-dibenzofuran-2-ylphenyl]-4-(4-cyanophenyl)benzonitrile;2-[3-[3-([1]benzofuro[3,2-c]carbazol-5-yl)-5-dibenzofuran-2-ylphenyl]phenyl]benzene-1,3-dicarbonitrile.

Molecular Properties

Compound Name2-[3-([1]benzofuro[2,3-b]carbazol-7-yl)-5-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-4-phenylbenzene-1,3-dicarbonitrile;2-[3-([1]benzofuro[3,2-c]carbazol-5-yl)-5-dibenzofuran-2-ylphenyl]-4-(4-cyanophenyl)benzonitrile;2-[3-[3-([1]benzofuro[3,2-c]carbazol-5-yl)-5-dibenzofuran-2-ylphenyl]phenyl]benzene-1,3-dicarbonitrile
PubChem CID159299264
Molecular FormulaC162H89N11O5
Molecular Weight2269.57 g/mol
Exact Mass2267.70
IUPAC Name2-[3-([1]benzofuro[2,3-b]carbazol-7-yl)-5-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-4-phenylbenzene-1,3-dicarbonitrile;2-[3-([1]benzofuro[3,2-c]carbazol-5-yl)-5-dibenzofuran-2-ylphenyl]-4-(4-cyanophenyl)benzonitrile;2-[3-[3-([1]benzofuro[3,2-c]carbazol-5-yl)-5-dibenzofuran-2-ylphenyl]phenyl]benzene-1,3-dicarbonitrile
SMILESN#Cc1ccc(-c2ccc(C#N)c(-c3cc(-c4ccc5oc6ccccc6c5c4)cc(-n4c5ccccc5c5c6oc7ccccc7c6ccc54)c3)c2)cc1.N#Cc1ccc(-c2ccccc2)c(C#N)c1-c1cc(-n2c3ccccc3c3cc4c(cc32)oc2ccccc24)cc(-n2c3ccccc3c3c2ccc2c4ccccc4n(-c4ccccc4)c23)c1.N#Cc1cccc(C#N)c1-c1cccc(-c2cc(-c3ccc4oc5ccccc5c4c3)cc(-n3c4ccccc4c4c5oc6ccccc6c5ccc43)c2)c1
InChIInChI=1S/C62H35N5O.2C50H27N3O2/c63-36-39-27-28-44(38-15-3-1-4-16-38)52(37-64)60(39)40-31-42(33-43(32-40)66-53-23-11-8-20-46(53)50-34-51-47-21-10-14-26-58(47)68-59(51)35-57(50)66)65-55-25-13-9-22-49(55)61-56(65)30-29-48-45-19-7-12-24-54(45)67(62(48)61)41-17-5-2-6-18-41;51-28-33-11-8-12-34(29-52)48(33)32-10-7-9-30(23-32)35-24-36(31-19-22-47-42(27-31)39-14-3-5-17-45(39)54-47)26-37(25-35)53-43-16-4-1-15-41(43)49-44(53)21-20-40-38-13-2-6-18-46(38)55-50(40)49;51-28-30-13-15-31(16-14-30)32-17-18-34(29-52)42(26-32)36-23-35(33-19-22-48-43(27-33)39-8-3-5-11-46(39)54-48)24-37(25-36)53-44-10-4-1-9-41(44)49-45(53)21-20-40-38-7-2-6-12-47(38)55-50(40)49/h1-35H;2*1-27H
InChIKeyLBCSRUSONVXLBJ-UHFFFAOYSA-N
XLogP42.61
TPSA233.09 Ų
H-Bond Donors
H-Bond Acceptors16
Rotatable Bonds13
Heavy Atoms178
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002269.57
LogP ≤ 542.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1016

Analyze 2-[3-([1]benzofuro[2,3-b]carbazol-7-yl)-5-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-4-phenylbenzene-1,3-dicarbonitrile;2-[3-([1]benzofuro[3,2-c]carbazol-5-yl)-5-dibenzofuran-2-ylphenyl]-4-(4-cyanophenyl)benzonitrile;2-[3-[3-([1]benzofuro[3,2-c]carbazol-5-yl)-5-dibenzofuran-2-ylphenyl]phenyl]benzene-1,3-dicarbonitrile with MolForge

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Related Compounds

2-[4-[3-([1]benzofuro[2,3-b]carbazol-7-yl)-5-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]phenyl]benzonitrile;2-[3-([1]benzofuro[3,2-c]carbazol-5-yl)-5-dibenzothiophen-2-ylphenyl]-5-phenylbenzene-1,3-dicarbonitrile;5-[3-([1]benzofuro[3,2-c]carbazol-5-yl)-5-dibenzothiophen-2-ylphenyl]-2-phenylbenzene-1,3-dicarbonitrile
CID 160928649
5-[3-([1]benzofuro[2,3-b]carbazol-7-yl)-5-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-2-phenylbenzene-1,3-dicarbonitrile
CID 139339961
2-[4-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-4-(12-phenylindolo[3,2-c]carbazol-5-yl)benzonitrile
CID 129291167
2-[2-([1]benzothiolo[2,3-b]carbazol-7-yl)-4-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-6-(3-cyanophenyl)benzonitrile;4-[2-([1]benzothiolo[2,3-b]carbazol-7-yl)-4-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-2-(3-cyanophenyl)benzonitrile;3-[2,4-bis([1]benzofuro[3,2-c]carbazol-5-yl)phenyl]-5-(3-cyanophenyl)benzonitrile
CID 161146073
6-[3-([1]benzofuro[3,2-c]carbazol-5-yl)-5-(2-cyanophenyl)phenyl]dibenzothiophene-2-carbonitrile;3-[3-dibenzofuran-3-yl-5-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]benzonitrile;4-[3-dibenzofuran-3-yl-5-(5-phenylindolo[3,2-b]carbazol-11-yl)phenyl]benzonitrile
CID 159607761
2-[2-[3-([1]benzofuro[3,2-c]carbazol-5-yl)-5-carbazol-9-ylphenyl]phenyl]benzonitrile;3-[2-[3-([1]benzofuro[3,2-c]carbazol-5-yl)-5-carbazol-9-ylphenyl]phenyl]benzonitrile;2-[3-carbazol-9-yl-5-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]benzonitrile;3-[3-carbazol-9-yl-5-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]benzonitrile
CID 159371749
2-[3-carbazol-9-yl-5-(7-phenylindolo[2,3-b]carbazol-5-yl)phenyl]benzonitrile;3-[3-carbazol-9-yl-5-(7-phenylindolo[2,3-b]carbazol-5-yl)phenyl]benzonitrile;2-[3-carbazol-9-yl-5-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]benzonitrile;3-[3-carbazol-9-yl-5-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]benzonitrile
CID 160706389
2-[3-carbazol-9-yl-5-(7-phenylindolo[2,3-b]carbazol-5-yl)phenyl]benzonitrile;3-[3-carbazol-9-yl-5-(7-phenylindolo[2,3-b]carbazol-5-yl)phenyl]benzonitrile;2-[3-carbazol-9-yl-5-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]benzonitrile
CID 157162467
2-[3-([1]benzofuro[3,2-b]carbazol-11-yl)-5-(9-phenylcarbazol-3-yl)phenyl]benzonitrile;4-[4-([1]benzofuro[3,2-c]carbazol-5-yl)-2-carbazol-9-ylphenyl]-2-phenylbenzonitrile;3-[5-([1]benzofuro[3,2-c]carbazol-5-yl)-1-carbazol-9-ylpyridin-1-ium-2-yl]-5-(2-cyanophenyl)benzonitrile
CID 159578870
3-([1]benzofuro[2,3-a]carbazol-12-yl)-5-(4-carbazol-9-ylphenyl)benzonitrile;3-([1]benzofuro[3,2-a]carbazol-12-yl)-5-(4-carbazol-9-ylphenyl)benzonitrile;3-([1]benzofuro[2,3-b]carbazol-7-yl)-5-(4-carbazol-9-ylphenyl)benzonitrile;3-([1]benzofuro[3,2-b]carbazol-11-yl)-5-(4-carbazol-9-ylphenyl)benzonitrile;3-([1]benzofuro[3,2-c]carbazol-5-yl)-5-(4-carbazol-9-ylphenyl)benzonitrile;3-(4-carbazol-9-ylphenyl)-5-(9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)benzonitrile
CID 165076473
3-([1]benzofuro[2,3-a]carbazol-12-yl)-5-(4-carbazol-9-ylphenyl)benzonitrile;3-([1]benzofuro[3,2-a]carbazol-12-yl)-5-(4-carbazol-9-ylphenyl)benzonitrile;3-([1]benzofuro[2,3-b]carbazol-7-yl)-5-(4-carbazol-9-ylphenyl)benzonitrile;3-([1]benzofuro[3,2-b]carbazol-11-yl)-5-(4-carbazol-9-ylphenyl)benzonitrile;3-[4-([1]benzofuro[3,2-c]carbazol-5-yl)phenyl]-5-carbazol-9-ylbenzonitrile;3-carbazol-9-yl-5-[4-(9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)phenyl]benzonitrile
CID 157319826
4-[4-(15-phenyl-4-oxa-15,24-diazaheptacyclo[14.11.0.02,14.03,11.05,10.017,25.018,23]heptacosa-1(16),2(14),3(11),5,7,9,12,17(25),18,20,22,26-dodecaen-24-yl)phenyl]benzonitrile
CID 126679075

Frequently Asked Questions

What is the IUPAC name of 2-[3-([1]benzofuro[2,3-b]carbazol-7-yl)-5-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-4-phenylbenzene-1,3-dicarbonitrile;2-[3-([1]benzofuro[3,2-c]carbazol-5-yl)-5-dibenzofuran-2-ylphenyl]-4-(4-cyanophenyl)benzonitrile;2-[3-[3-([1]benzofuro[3,2-c]carbazol-5-yl)-5-dibenzofuran-2-ylphenyl]phenyl]benzene-1,3-dicarbonitrile?
The IUPAC name of 2-[3-([1]benzofuro[2,3-b]carbazol-7-yl)-5-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-4-phenylbenzene-1,3-dicarbonitrile;2-[3-([1]benzofuro[3,2-c]carbazol-5-yl)-5-dibenzofuran-2-ylphenyl]-4-(4-cyanophenyl)benzonitrile;2-[3-[3-([1]benzofuro[3,2-c]carbazol-5-yl)-5-dibenzofuran-2-ylphenyl]phenyl]benzene-1,3-dicarbonitrile (CID 159299264) is 2-[3-([1]benzofuro[2,3-b]carbazol-7-yl)-5-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-4-phenylbenzene-1,3-dicarbonitrile;2-[3-([1]benzofuro[3,2-c]carbazol-5-yl)-5-dibenzofuran-2-ylphenyl]-4-(4-cyanophenyl)benzonitrile;2-[3-[3-([1]benzofuro[3,2-c]carbazol-5-yl)-5-dibenzofuran-2-ylphenyl]phenyl]benzene-1,3-dicarbonitrile.
What is the SMILES notation for 2-[3-([1]benzofuro[2,3-b]carbazol-7-yl)-5-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-4-phenylbenzene-1,3-dicarbonitrile;2-[3-([1]benzofuro[3,2-c]carbazol-5-yl)-5-dibenzofuran-2-ylphenyl]-4-(4-cyanophenyl)benzonitrile;2-[3-[3-([1]benzofuro[3,2-c]carbazol-5-yl)-5-dibenzofuran-2-ylphenyl]phenyl]benzene-1,3-dicarbonitrile?
The canonical SMILES for 2-[3-([1]benzofuro[2,3-b]carbazol-7-yl)-5-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-4-phenylbenzene-1,3-dicarbonitrile;2-[3-([1]benzofuro[3,2-c]carbazol-5-yl)-5-dibenzofuran-2-ylphenyl]-4-(4-cyanophenyl)benzonitrile;2-[3-[3-([1]benzofuro[3,2-c]carbazol-5-yl)-5-dibenzofuran-2-ylphenyl]phenyl]benzene-1,3-dicarbonitrile is N#Cc1ccc(-c2ccc(C#N)c(-c3cc(-c4ccc5oc6ccccc6c5c4)cc(-n4c5ccccc5c5c6oc7ccccc7c6ccc54)c3)c2)cc1.N#Cc1ccc(-c2ccccc2)c(C#N)c1-c1cc(-n2c3ccccc3c3cc4c(cc32)oc2ccccc24)cc(-n2c3ccccc3c3c2ccc2c4ccccc4n(-c4ccccc4)c23)c1.N#Cc1cccc(C#N)c1-c1cccc(-c2cc(-c3ccc4oc5ccccc5c4c3)cc(-n3c4ccccc4c4c5oc6ccccc6c5ccc43)c2)c1.
What is the InChIKey of 2-[3-([1]benzofuro[2,3-b]carbazol-7-yl)-5-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-4-phenylbenzene-1,3-dicarbonitrile;2-[3-([1]benzofuro[3,2-c]carbazol-5-yl)-5-dibenzofuran-2-ylphenyl]-4-(4-cyanophenyl)benzonitrile;2-[3-[3-([1]benzofuro[3,2-c]carbazol-5-yl)-5-dibenzofuran-2-ylphenyl]phenyl]benzene-1,3-dicarbonitrile?
The InChIKey is LBCSRUSONVXLBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C62H35N5O.2C50H27N3O2/c63-36-39-27-28-44(38-15-3-1-4-16-38)52(37-64)60(39)40-31-42(33-43(32-40)66-53-23-11-8-20-46(53)50-34-51-47-21-10-14-26-58(47)68-59(51)35-57(50)66)65-55-25-13-9-22-49(55)61-56(65)30-29-48-45-19-7-12-24-54(45)67(62(48)61)41-17-5-2-6-18-41;51-28-33-11-8-12-34(29-52)48(33)32-10-7-9-30(23-32)35-24-36(31-19-22-47-42(27-31)39-14-3-5-17-45(39)54-47)26-37(25-35)53-43-16-4-1-15-41(43)49-44(53)21-20-40-38-13-2-6-18-46(38)55-50(40)49;51-28-30-13-15-31(16-14-30)32-17-18-34(29-52)42(26-32)36-23-35(33-19-22-48-43(27-33)39-8-3-5-11-46(39)54-48)24-37(25-36)53-44-10-4-1-9-41(44)49-45(53)21-20-40-38-7-2-6-12-47(38)55-50(40)49/h1-35H;2*1-27H.
What are the key properties of 2-[3-([1]benzofuro[2,3-b]carbazol-7-yl)-5-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-4-phenylbenzene-1,3-dicarbonitrile;2-[3-([1]benzofuro[3,2-c]carbazol-5-yl)-5-dibenzofuran-2-ylphenyl]-4-(4-cyanophenyl)benzonitrile;2-[3-[3-([1]benzofuro[3,2-c]carbazol-5-yl)-5-dibenzofuran-2-ylphenyl]phenyl]benzene-1,3-dicarbonitrile?
2-[3-([1]benzofuro[2,3-b]carbazol-7-yl)-5-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-4-phenylbenzene-1,3-dicarbonitrile;2-[3-([1]benzofuro[3,2-c]carbazol-5-yl)-5-dibenzofuran-2-ylphenyl]-4-(4-cyanophenyl)benzonitrile;2-[3-[3-([1]benzofuro[3,2-c]carbazol-5-yl)-5-dibenzofuran-2-ylphenyl]phenyl]benzene-1,3-dicarbonitrile has a molecular weight of 2269.57 g/mol, XLogP of 42.61, 13 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-([1]benzofuro[2,3-b]carbazol-7-yl)-5-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-4-phenylbenzene-1,3-dicarbonitrile;2-[3-([1]benzofuro[3,2-c]carbazol-5-yl)-5-dibenzofuran-2-ylphenyl]-4-(4-cyanophenyl)benzonitrile;2-[3-[3-([1]benzofuro[3,2-c]carbazol-5-yl)-5-dibenzofuran-2-ylphenyl]phenyl]benzene-1,3-dicarbonitrile is sourced from PubChem (CID 159299264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).