2-[2,5-diphenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]benzene-1,4-dicarbonitrile;2-[2,6-diphenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]benzene-1,4-dicarbonitrile;3-[3,5-diphenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]-4-isocyanobenzonitrile;2-[2-phenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]benzene-1,4-dicarbonitrile

C194H116N16 — CID 159219819

IUPAC2-[2,5-diphenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]benzene-1,4-dicarbonitrile;2-[2,6-diphenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]benzene-1,4-dicarbonitrile;3-[3,5-diphenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]-4-isocyanobenzonitrile;2-[2-phenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]benzene-1,4-dicarbonitrile
SMILESN#Cc1ccc(C#N)c(-c2c(-c3ccccc3)cc(-n3c4ccccc4c4ccc5c(c6ccccc6n5-c5ccccc5)c43)cc2-c2ccccc2)c1.N#Cc1ccc(C#N)c(-c2cc(-c3ccccc3)c(-n3c4ccccc4c4ccc5c(c6ccccc6n5-c5ccccc5)c43)cc2-c2ccccc2)c1.N#Cc1ccc(C#N)c(-c2ccc(-n3c4ccccc4c4ccc5c(c6ccccc6n5-c5ccccc5)c43)cc2-c2ccccc2)c1.[C-]#[N+]c1ccc(C#N)cc1-c1cc(-c2ccccc2)c(-n2c3ccccc3c3ccc4c(c5ccccc5n4-c4ccccc4)c32)c(-c2ccccc2)c1
InChIInChI=1S/3C50H30N4.C44H26N4/c1-52-44-27-25-33(32-51)29-41(44)36-30-42(34-15-5-2-6-16-34)49(43(31-36)35-17-7-3-8-18-35)54-45-23-13-11-21-38(45)39-26-28-47-48(50(39)54)40-22-12-14-24-46(40)53(47)37-19-9-4-10-20-37;51-31-33-24-25-36(32-52)42(28-33)48-43(34-14-4-1-5-15-34)29-38(30-44(48)35-16-6-2-7-17-35)54-45-22-12-10-20-39(45)40-26-27-47-49(50(40)54)41-21-11-13-23-46(41)53(47)37-18-8-3-9-19-37;51-31-33-24-25-36(32-52)41(28-33)44-29-43(35-16-6-2-7-17-35)48(30-42(44)34-14-4-1-5-15-34)54-45-22-12-10-20-38(45)39-26-27-47-49(50(39)54)40-21-11-13-23-46(40)53(47)37-18-8-3-9-19-37;45-27-29-19-20-31(28-46)38(25-29)34-22-21-33(26-39(34)30-11-3-1-4-12-30)48-40-17-9-7-15-35(40)36-23-24-42-43(44(36)48)37-16-8-10-18-41(37)47(42)32-13-5-2-6-14-32/h2-31H;2*1-30H;1-26H
InChIKeyKRNSUOMQQYZRLL-UHFFFAOYSA-N
MW2671.17 g/mol
LogP49.51
Rot. Bonds19

About 2-[2,5-diphenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]benzene-1,4-dicarbonitrile;2-[2,6-diphenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]benzene-1,4-dicarbonitrile;3-[3,5-diphenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]-4-isocyanobenzonitrile;2-[2-phenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]benzene-1,4-dicarbonitrile

2-[2,5-diphenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]benzene-1,4-dicarbonitrile;2-[2,6-diphenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]benzene-1,4-dicarbonitrile;3-[3,5-diphenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]-4-isocyanobenzonitrile;2-[2-phenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]benzene-1,4-dicarbonitrile (PubChem CID 159219819) has the molecular formula C194H116N16 and a molecular weight of 2671.17 g/mol. Its IUPAC name is 2-[2,5-diphenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]benzene-1,4-dicarbonitrile;2-[2,6-diphenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]benzene-1,4-dicarbonitrile;3-[3,5-diphenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]-4-isocyanobenzonitrile;2-[2-phenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]benzene-1,4-dicarbonitrile.

Molecular Properties

Compound Name2-[2,5-diphenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]benzene-1,4-dicarbonitrile;2-[2,6-diphenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]benzene-1,4-dicarbonitrile;3-[3,5-diphenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]-4-isocyanobenzonitrile;2-[2-phenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]benzene-1,4-dicarbonitrile
PubChem CID159219819
Molecular FormulaC194H116N16
Molecular Weight2671.17 g/mol
Exact Mass2668.96
IUPAC Name2-[2,5-diphenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]benzene-1,4-dicarbonitrile;2-[2,6-diphenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]benzene-1,4-dicarbonitrile;3-[3,5-diphenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]-4-isocyanobenzonitrile;2-[2-phenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]benzene-1,4-dicarbonitrile
SMILESN#Cc1ccc(C#N)c(-c2c(-c3ccccc3)cc(-n3c4ccccc4c4ccc5c(c6ccccc6n5-c5ccccc5)c43)cc2-c2ccccc2)c1.N#Cc1ccc(C#N)c(-c2cc(-c3ccccc3)c(-n3c4ccccc4c4ccc5c(c6ccccc6n5-c5ccccc5)c43)cc2-c2ccccc2)c1.N#Cc1ccc(C#N)c(-c2ccc(-n3c4ccccc4c4ccc5c(c6ccccc6n5-c5ccccc5)c43)cc2-c2ccccc2)c1.[C-]#[N+]c1ccc(C#N)cc1-c1cc(-c2ccccc2)c(-n2c3ccccc3c3ccc4c(c5ccccc5n4-c4ccccc4)c32)c(-c2ccccc2)c1
InChIInChI=1S/3C50H30N4.C44H26N4/c1-52-44-27-25-33(32-51)29-41(44)36-30-42(34-15-5-2-6-16-34)49(43(31-36)35-17-7-3-8-18-35)54-45-23-13-11-21-38(45)39-26-28-47-48(50(39)54)40-22-12-14-24-46(40)53(47)37-19-9-4-10-20-37;51-31-33-24-25-36(32-52)42(28-33)48-43(34-14-4-1-5-15-34)29-38(30-44(48)35-16-6-2-7-17-35)54-45-22-12-10-20-39(45)40-26-27-47-49(50(40)54)41-21-11-13-23-46(41)53(47)37-18-8-3-9-19-37;51-31-33-24-25-36(32-52)41(28-33)44-29-43(35-16-6-2-7-17-35)48(30-42(44)34-14-4-1-5-15-34)54-45-22-12-10-20-38(45)39-26-27-47-49(50(39)54)40-21-11-13-23-46(40)53(47)37-18-8-3-9-19-37;45-27-29-19-20-31(28-46)38(25-29)34-22-21-33(26-39(34)30-11-3-1-4-12-30)48-40-17-9-7-15-35(40)36-23-24-42-43(44(36)48)37-16-8-10-18-41(37)47(42)32-13-5-2-6-14-32/h2-31H;2*1-30H;1-26H
InChIKeyKRNSUOMQQYZRLL-UHFFFAOYSA-N
XLogP49.51
TPSA210.33 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds19
Heavy Atoms210
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002671.17
LogP ≤ 549.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Analyze 2-[2,5-diphenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]benzene-1,4-dicarbonitrile;2-[2,6-diphenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]benzene-1,4-dicarbonitrile;3-[3,5-diphenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]-4-isocyanobenzonitrile;2-[2-phenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]benzene-1,4-dicarbonitrile with MolForge

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Related Compounds

3-[3,5-diphenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]-4-isocyanobenzonitrile
CID 140903189
2-[2-phenyl-4-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]benzene-1,4-dicarbonitrile
CID 140903238
2-[4-(3-carbazol-9-ylcarbazol-9-yl)-2,6-diphenylphenyl]benzene-1,4-dicarbonitrile
CID 140903234
4-[4-[3,6-di(carbazol-9-yl)carbazol-9-yl]-2,5-diphenylphenyl]-3-isocyanobenzonitrile
CID 140903301
4-[4-(9-carbazol-9-yl-5-phenylindolo[3,2-c]carbazol-12-yl)-2,6-diphenylphenyl]benzene-1,2-dicarbonitrile
CID 140903284
2-(4-carbazol-9-yl-2,5-diphenylphenyl)benzene-1,4-dicarbonitrile
CID 140903311
2-[4-(9-carbazol-9-yl-5-phenylindolo[3,2-c]carbazol-12-yl)-2-phenylphenyl]benzene-1,3-dicarbonitrile
CID 147481564
4-(15,24-diphenyl-6,15,24-triazaheptacyclo[14.11.0.02,14.05,13.07,12.017,25.018,23]heptacosa-1(16),2(14),3,5(13),7,9,11,17(25),18,20,22,26-dodecaen-6-yl)-3-phenylbenzonitrile
CID 146180146
4-[3-(2-cyano-4-isocyanophenyl)-5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]benzene-1,3-dicarbonitrile
CID 155656730
4-isocyano-2,5-bis(5-phenylindolo[3,2-c]carbazol-12-yl)benzonitrile
CID 153461944
4-carbazol-9-yl-3-[4-cyano-3-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]-5-isocyanobenzonitrile
CID 163449231
9-[3-[3-(9-isocyano-5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]phenyl]carbazole-3-carbonitrile
CID 140822760

Frequently Asked Questions

What is the IUPAC name of 2-[2,5-diphenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]benzene-1,4-dicarbonitrile;2-[2,6-diphenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]benzene-1,4-dicarbonitrile;3-[3,5-diphenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]-4-isocyanobenzonitrile;2-[2-phenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]benzene-1,4-dicarbonitrile?
The IUPAC name of 2-[2,5-diphenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]benzene-1,4-dicarbonitrile;2-[2,6-diphenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]benzene-1,4-dicarbonitrile;3-[3,5-diphenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]-4-isocyanobenzonitrile;2-[2-phenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]benzene-1,4-dicarbonitrile (CID 159219819) is 2-[2,5-diphenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]benzene-1,4-dicarbonitrile;2-[2,6-diphenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]benzene-1,4-dicarbonitrile;3-[3,5-diphenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]-4-isocyanobenzonitrile;2-[2-phenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]benzene-1,4-dicarbonitrile.
What is the SMILES notation for 2-[2,5-diphenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]benzene-1,4-dicarbonitrile;2-[2,6-diphenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]benzene-1,4-dicarbonitrile;3-[3,5-diphenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]-4-isocyanobenzonitrile;2-[2-phenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]benzene-1,4-dicarbonitrile?
The canonical SMILES for 2-[2,5-diphenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]benzene-1,4-dicarbonitrile;2-[2,6-diphenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]benzene-1,4-dicarbonitrile;3-[3,5-diphenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]-4-isocyanobenzonitrile;2-[2-phenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]benzene-1,4-dicarbonitrile is N#Cc1ccc(C#N)c(-c2c(-c3ccccc3)cc(-n3c4ccccc4c4ccc5c(c6ccccc6n5-c5ccccc5)c43)cc2-c2ccccc2)c1.N#Cc1ccc(C#N)c(-c2cc(-c3ccccc3)c(-n3c4ccccc4c4ccc5c(c6ccccc6n5-c5ccccc5)c43)cc2-c2ccccc2)c1.N#Cc1ccc(C#N)c(-c2ccc(-n3c4ccccc4c4ccc5c(c6ccccc6n5-c5ccccc5)c43)cc2-c2ccccc2)c1.[C-]#[N+]c1ccc(C#N)cc1-c1cc(-c2ccccc2)c(-n2c3ccccc3c3ccc4c(c5ccccc5n4-c4ccccc4)c32)c(-c2ccccc2)c1.
What is the InChIKey of 2-[2,5-diphenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]benzene-1,4-dicarbonitrile;2-[2,6-diphenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]benzene-1,4-dicarbonitrile;3-[3,5-diphenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]-4-isocyanobenzonitrile;2-[2-phenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]benzene-1,4-dicarbonitrile?
The InChIKey is KRNSUOMQQYZRLL-UHFFFAOYSA-N. The full InChI is InChI=1S/3C50H30N4.C44H26N4/c1-52-44-27-25-33(32-51)29-41(44)36-30-42(34-15-5-2-6-16-34)49(43(31-36)35-17-7-3-8-18-35)54-45-23-13-11-21-38(45)39-26-28-47-48(50(39)54)40-22-12-14-24-46(40)53(47)37-19-9-4-10-20-37;51-31-33-24-25-36(32-52)42(28-33)48-43(34-14-4-1-5-15-34)29-38(30-44(48)35-16-6-2-7-17-35)54-45-22-12-10-20-39(45)40-26-27-47-49(50(40)54)41-21-11-13-23-46(41)53(47)37-18-8-3-9-19-37;51-31-33-24-25-36(32-52)41(28-33)44-29-43(35-16-6-2-7-17-35)48(30-42(44)34-14-4-1-5-15-34)54-45-22-12-10-20-38(45)39-26-27-47-49(50(39)54)40-21-11-13-23-46(40)53(47)37-18-8-3-9-19-37;45-27-29-19-20-31(28-46)38(25-29)34-22-21-33(26-39(34)30-11-3-1-4-12-30)48-40-17-9-7-15-35(40)36-23-24-42-43(44(36)48)37-16-8-10-18-41(37)47(42)32-13-5-2-6-14-32/h2-31H;2*1-30H;1-26H.
What are the key properties of 2-[2,5-diphenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]benzene-1,4-dicarbonitrile;2-[2,6-diphenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]benzene-1,4-dicarbonitrile;3-[3,5-diphenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]-4-isocyanobenzonitrile;2-[2-phenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]benzene-1,4-dicarbonitrile?
2-[2,5-diphenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]benzene-1,4-dicarbonitrile;2-[2,6-diphenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]benzene-1,4-dicarbonitrile;3-[3,5-diphenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]-4-isocyanobenzonitrile;2-[2-phenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]benzene-1,4-dicarbonitrile has a molecular weight of 2671.17 g/mol, XLogP of 49.51, 19 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2,5-diphenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]benzene-1,4-dicarbonitrile;2-[2,6-diphenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]benzene-1,4-dicarbonitrile;3-[3,5-diphenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]-4-isocyanobenzonitrile;2-[2-phenyl-4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]benzene-1,4-dicarbonitrile is sourced from PubChem (CID 159219819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).