3-(3-cyanocarbazol-9-yl)-4-(3-triphenylsilylphenyl)benzene-1,2-dicarbonitrile;9-[2-cyano-6-(2-cyano-5-triphenylsilylphenyl)phenyl]carbazole-3-carbonitrile;9-[2-(3-cyano-2-triphenylsilylphenyl)-6-isocyanophenyl]carbazole-3-carbonitrile;3-[5-isocyano-2-(3-isocyanocarbazol-9-yl)phenyl]-2-triphenylsilylbenzonitrile

C180H112N16Si4 — CID 160610331

IUPAC3-(3-cyanocarbazol-9-yl)-4-(3-triphenylsilylphenyl)benzene-1,2-dicarbonitrile;9-[2-cyano-6-(2-cyano-5-triphenylsilylphenyl)phenyl]carbazole-3-carbonitrile;9-[2-(3-cyano-2-triphenylsilylphenyl)-6-isocyanophenyl]carbazole-3-carbonitrile;3-[5-isocyano-2-(3-isocyanocarbazol-9-yl)phenyl]-2-triphenylsilylbenzonitrile
SMILESN#Cc1ccc2c(c1)c1ccccc1n2-c1c(-c2cccc([Si](c3ccccc3)(c3ccccc3)c3ccccc3)c2)ccc(C#N)c1C#N.N#Cc1ccc2c(c1)c1ccccc1n2-c1c(C#N)cccc1-c1cc([Si](c2ccccc2)(c2ccccc2)c2ccccc2)ccc1C#N.[C-]#[N+]c1ccc(-n2c3ccccc3c3cc([N+]#[C-])ccc32)c(-c2cccc(C#N)c2[Si](c2ccccc2)(c2ccccc2)c2ccccc2)c1.[C-]#[N+]c1cccc(-c2cccc(C#N)c2[Si](c2ccccc2)(c2ccccc2)c2ccccc2)c1-n1c2ccccc2c2cc(C#N)ccc21
InChIInChI=1S/4C45H28N4Si/c1-47-33-25-27-43-40(29-33)38-22-12-13-24-42(38)49(43)44-28-26-34(48-2)30-41(44)39-23-14-15-32(31-46)45(39)50(35-16-6-3-7-17-35,36-18-8-4-9-19-36)37-20-10-5-11-21-37;1-48-41-25-14-23-38(44(41)49-42-26-12-11-22-37(42)40-29-32(30-46)27-28-43(40)49)39-24-13-15-33(31-47)45(39)50(34-16-5-2-6-17-34,35-18-7-3-8-19-35)36-20-9-4-10-21-36;46-29-32-23-26-44-41(27-32)40-21-10-11-22-43(40)49(44)45-39(25-24-34(30-47)42(45)31-48)33-13-12-20-38(28-33)50(35-14-4-1-5-15-35,36-16-6-2-7-17-36)37-18-8-3-9-19-37;46-29-32-23-26-44-42(27-32)39-20-10-11-22-43(39)49(44)45-34(31-48)13-12-21-40(45)41-28-38(25-24-33(41)30-47)50(35-14-4-1-5-15-35,36-16-6-2-7-17-36)37-18-8-3-9-19-37/h3-30H;2-29H;2*1-28H
InChIKeyRFKXTKQYRLTOSD-UHFFFAOYSA-N
MW2611.33 g/mol
LogP31.81
Rot. Bonds24

About 3-(3-cyanocarbazol-9-yl)-4-(3-triphenylsilylphenyl)benzene-1,2-dicarbonitrile;9-[2-cyano-6-(2-cyano-5-triphenylsilylphenyl)phenyl]carbazole-3-carbonitrile;9-[2-(3-cyano-2-triphenylsilylphenyl)-6-isocyanophenyl]carbazole-3-carbonitrile;3-[5-isocyano-2-(3-isocyanocarbazol-9-yl)phenyl]-2-triphenylsilylbenzonitrile

3-(3-cyanocarbazol-9-yl)-4-(3-triphenylsilylphenyl)benzene-1,2-dicarbonitrile;9-[2-cyano-6-(2-cyano-5-triphenylsilylphenyl)phenyl]carbazole-3-carbonitrile;9-[2-(3-cyano-2-triphenylsilylphenyl)-6-isocyanophenyl]carbazole-3-carbonitrile;3-[5-isocyano-2-(3-isocyanocarbazol-9-yl)phenyl]-2-triphenylsilylbenzonitrile (PubChem CID 160610331) has the molecular formula C180H112N16Si4 and a molecular weight of 2611.33 g/mol. Its IUPAC name is 3-(3-cyanocarbazol-9-yl)-4-(3-triphenylsilylphenyl)benzene-1,2-dicarbonitrile;9-[2-cyano-6-(2-cyano-5-triphenylsilylphenyl)phenyl]carbazole-3-carbonitrile;9-[2-(3-cyano-2-triphenylsilylphenyl)-6-isocyanophenyl]carbazole-3-carbonitrile;3-[5-isocyano-2-(3-isocyanocarbazol-9-yl)phenyl]-2-triphenylsilylbenzonitrile.

Molecular Properties

Compound Name3-(3-cyanocarbazol-9-yl)-4-(3-triphenylsilylphenyl)benzene-1,2-dicarbonitrile;9-[2-cyano-6-(2-cyano-5-triphenylsilylphenyl)phenyl]carbazole-3-carbonitrile;9-[2-(3-cyano-2-triphenylsilylphenyl)-6-isocyanophenyl]carbazole-3-carbonitrile;3-[5-isocyano-2-(3-isocyanocarbazol-9-yl)phenyl]-2-triphenylsilylbenzonitrile
PubChem CID160610331
Molecular FormulaC180H112N16Si4
Molecular Weight2611.33 g/mol
Exact Mass2608.83
IUPAC Name3-(3-cyanocarbazol-9-yl)-4-(3-triphenylsilylphenyl)benzene-1,2-dicarbonitrile;9-[2-cyano-6-(2-cyano-5-triphenylsilylphenyl)phenyl]carbazole-3-carbonitrile;9-[2-(3-cyano-2-triphenylsilylphenyl)-6-isocyanophenyl]carbazole-3-carbonitrile;3-[5-isocyano-2-(3-isocyanocarbazol-9-yl)phenyl]-2-triphenylsilylbenzonitrile
SMILESN#Cc1ccc2c(c1)c1ccccc1n2-c1c(-c2cccc([Si](c3ccccc3)(c3ccccc3)c3ccccc3)c2)ccc(C#N)c1C#N.N#Cc1ccc2c(c1)c1ccccc1n2-c1c(C#N)cccc1-c1cc([Si](c2ccccc2)(c2ccccc2)c2ccccc2)ccc1C#N.[C-]#[N+]c1ccc(-n2c3ccccc3c3cc([N+]#[C-])ccc32)c(-c2cccc(C#N)c2[Si](c2ccccc2)(c2ccccc2)c2ccccc2)c1.[C-]#[N+]c1cccc(-c2cccc(C#N)c2[Si](c2ccccc2)(c2ccccc2)c2ccccc2)c1-n1c2ccccc2c2cc(C#N)ccc21
InChIInChI=1S/4C45H28N4Si/c1-47-33-25-27-43-40(29-33)38-22-12-13-24-42(38)49(43)44-28-26-34(48-2)30-41(44)39-23-14-15-32(31-46)45(39)50(35-16-6-3-7-17-35,36-18-8-4-9-19-36)37-20-10-5-11-21-37;1-48-41-25-14-23-38(44(41)49-42-26-12-11-22-37(42)40-29-32(30-46)27-28-43(40)49)39-24-13-15-33(31-47)45(39)50(34-16-5-2-6-17-34,35-18-7-3-8-19-35)36-20-9-4-10-21-36;46-29-32-23-26-44-41(27-32)40-21-10-11-22-43(40)49(44)45-39(25-24-34(30-47)42(45)31-48)33-13-12-20-38(28-33)50(35-14-4-1-5-15-35,36-16-6-2-7-17-36)37-18-8-3-9-19-37;46-29-32-23-26-44-42(27-32)39-20-10-11-22-43(39)49(44)45-34(31-48)13-12-21-40(45)41-28-38(25-24-33(41)30-47)50(35-14-4-1-5-15-35,36-16-6-2-7-17-36)37-18-8-3-9-19-37/h3-30H;2-29H;2*1-28H
InChIKeyRFKXTKQYRLTOSD-UHFFFAOYSA-N
XLogP31.81
TPSA246.91 Ų
H-Bond Donors
H-Bond Acceptors13
Rotatable Bonds24
Heavy Atoms200
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002611.33
LogP ≤ 531.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1013

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

Analyze 3-(3-cyanocarbazol-9-yl)-4-(3-triphenylsilylphenyl)benzene-1,2-dicarbonitrile;9-[2-cyano-6-(2-cyano-5-triphenylsilylphenyl)phenyl]carbazole-3-carbonitrile;9-[2-(3-cyano-2-triphenylsilylphenyl)-6-isocyanophenyl]carbazole-3-carbonitrile;3-[5-isocyano-2-(3-isocyanocarbazol-9-yl)phenyl]-2-triphenylsilylbenzonitrile 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

3-(3-cyanocarbazol-9-yl)-4-(3-triphenylsilylphenyl)benzene-1,2-dicarbonitrile
CID 153318472
3-(2-carbazol-9-yl-5-isocyanophenyl)-2-triphenylsilylbenzonitrile
CID 153318522
9-[2-[2-carbazol-9-yl-3-(3-isocyanophenyl)phenyl]phenyl]carbazole;2-[3-(2-carbazol-9-ylphenyl)-2-(3-isocyanocarbazol-9-yl)phenyl]benzonitrile;9-[2-(2-carbazol-9-yl-3-phenylphenyl)-6-cyanophenyl]carbazole-3-carbonitrile;9-[2-[3-(2-cyanophenyl)-2-(3-isocyanocarbazol-9-yl)phenyl]phenyl]carbazole-3-carbonitrile
CID 157352545
9-[2-(2-carbazol-9-yl-3-cyanophenyl)phenyl]carbazole-3-carbonitrile;9-[2-(2-carbazol-9-yl-4-cyanophenyl)phenyl]carbazole-3-carbonitrile;9-[2-(2-carbazol-9-yl-5-isocyanophenyl)phenyl]carbazole-3-carbonitrile;9-[2-[3-cyano-2-(3-cyanocarbazol-9-yl)phenyl]phenyl]carbazole-3-carbonitrile;9-[2-[4-cyano-2-(3-cyanocarbazol-9-yl)phenyl]phenyl]carbazole-3-carbonitrile;9-[4-cyano-2-[2-(3-cyanocarbazol-9-yl)phenyl]phenyl]carbazole-3-carbonitrile
CID 158250741
4-(4-cyano-3-triphenylsilylphenyl)-3-(3-isocyanocarbazol-9-yl)benzonitrile;9-[2-(4-cyano-2-triphenylsilylphenyl)-6-isocyanophenyl]carbazole-3-carbonitrile;9-[5-(4-cyano-2-triphenylsilylphenyl)-2-isocyanophenyl]carbazole-3-carbonitrile;2-[3-isocyano-2-(3-isocyanocarbazol-9-yl)phenyl]-5-triphenylsilylbenzonitrile
CID 159996585
2-(4-carbazol-9-ylcarbazol-9-yl)-3-[2-(3-isocyanocarbazol-9-yl)phenyl]benzonitrile;3-(4-carbazol-9-ylcarbazol-9-yl)-4-[2-(3-isocyanocarbazol-9-yl)phenyl]benzonitrile;4-carbazol-9-yl-9-[3-isocyano-2-[2-(3-isocyanocarbazol-9-yl)phenyl]phenyl]carbazole;4-carbazol-9-yl-9-[4-isocyano-2-[2-(3-isocyanocarbazol-9-yl)phenyl]phenyl]carbazole
CID 158148881
9-[2-(2-cyano-4-triphenylsilylphenyl)-5-isocyanophenyl]carbazole-3-carbonitrile
CID 153318709
9-[2-(4-cyano-2-isocyano-6-triphenylsilylphenyl)phenyl]carbazole-3-carbonitrile;9-[3-(4-cyano-2-isocyano-6-triphenylsilylphenyl)phenyl]carbazole-3-carbonitrile;3-(2-cyano-4-triphenylsilylphenyl)-4-(3-isocyanocarbazol-9-yl)benzonitrile;3-isocyano-5-(3-isocyanocarbazol-9-yl)-4-(3-triphenylsilylphenyl)benzonitrile
CID 161044078
2-carbazol-9-yl-3-(2-cyano-5-triphenylsilylphenyl)benzonitrile
CID 153318477
4-[2-(3-cyanocarbazol-9-yl)phenyl]-5-triphenylsilylbenzene-1,2-dicarbonitrile;4-[3-(3-cyanocarbazol-9-yl)phenyl]-5-triphenylsilylbenzene-1,2-dicarbonitrile;9-[3-cyano-2-(2-cyano-4-triphenylsilylphenyl)phenyl]carbazole-3-carbonitrile;4-(3-isocyanocarbazol-9-yl)-5-(3-triphenylsilylphenyl)benzene-1,2-dicarbonitrile;methane
CID 158750600
2-(3-isocyanocarbazol-9-yl)-5-(3-triphenylsilylphenyl)benzonitrile
CID 153318850
9-[2-cyano-5-isocyano-4-(4-triphenylsilylphenyl)phenyl]carbazole-3-carbonitrile
CID 153318525

Frequently Asked Questions

What is the IUPAC name of 3-(3-cyanocarbazol-9-yl)-4-(3-triphenylsilylphenyl)benzene-1,2-dicarbonitrile;9-[2-cyano-6-(2-cyano-5-triphenylsilylphenyl)phenyl]carbazole-3-carbonitrile;9-[2-(3-cyano-2-triphenylsilylphenyl)-6-isocyanophenyl]carbazole-3-carbonitrile;3-[5-isocyano-2-(3-isocyanocarbazol-9-yl)phenyl]-2-triphenylsilylbenzonitrile?
The IUPAC name of 3-(3-cyanocarbazol-9-yl)-4-(3-triphenylsilylphenyl)benzene-1,2-dicarbonitrile;9-[2-cyano-6-(2-cyano-5-triphenylsilylphenyl)phenyl]carbazole-3-carbonitrile;9-[2-(3-cyano-2-triphenylsilylphenyl)-6-isocyanophenyl]carbazole-3-carbonitrile;3-[5-isocyano-2-(3-isocyanocarbazol-9-yl)phenyl]-2-triphenylsilylbenzonitrile (CID 160610331) is 3-(3-cyanocarbazol-9-yl)-4-(3-triphenylsilylphenyl)benzene-1,2-dicarbonitrile;9-[2-cyano-6-(2-cyano-5-triphenylsilylphenyl)phenyl]carbazole-3-carbonitrile;9-[2-(3-cyano-2-triphenylsilylphenyl)-6-isocyanophenyl]carbazole-3-carbonitrile;3-[5-isocyano-2-(3-isocyanocarbazol-9-yl)phenyl]-2-triphenylsilylbenzonitrile.
What is the SMILES notation for 3-(3-cyanocarbazol-9-yl)-4-(3-triphenylsilylphenyl)benzene-1,2-dicarbonitrile;9-[2-cyano-6-(2-cyano-5-triphenylsilylphenyl)phenyl]carbazole-3-carbonitrile;9-[2-(3-cyano-2-triphenylsilylphenyl)-6-isocyanophenyl]carbazole-3-carbonitrile;3-[5-isocyano-2-(3-isocyanocarbazol-9-yl)phenyl]-2-triphenylsilylbenzonitrile?
The canonical SMILES for 3-(3-cyanocarbazol-9-yl)-4-(3-triphenylsilylphenyl)benzene-1,2-dicarbonitrile;9-[2-cyano-6-(2-cyano-5-triphenylsilylphenyl)phenyl]carbazole-3-carbonitrile;9-[2-(3-cyano-2-triphenylsilylphenyl)-6-isocyanophenyl]carbazole-3-carbonitrile;3-[5-isocyano-2-(3-isocyanocarbazol-9-yl)phenyl]-2-triphenylsilylbenzonitrile is N#Cc1ccc2c(c1)c1ccccc1n2-c1c(-c2cccc([Si](c3ccccc3)(c3ccccc3)c3ccccc3)c2)ccc(C#N)c1C#N.N#Cc1ccc2c(c1)c1ccccc1n2-c1c(C#N)cccc1-c1cc([Si](c2ccccc2)(c2ccccc2)c2ccccc2)ccc1C#N.[C-]#[N+]c1ccc(-n2c3ccccc3c3cc([N+]#[C-])ccc32)c(-c2cccc(C#N)c2[Si](c2ccccc2)(c2ccccc2)c2ccccc2)c1.[C-]#[N+]c1cccc(-c2cccc(C#N)c2[Si](c2ccccc2)(c2ccccc2)c2ccccc2)c1-n1c2ccccc2c2cc(C#N)ccc21.
What is the InChIKey of 3-(3-cyanocarbazol-9-yl)-4-(3-triphenylsilylphenyl)benzene-1,2-dicarbonitrile;9-[2-cyano-6-(2-cyano-5-triphenylsilylphenyl)phenyl]carbazole-3-carbonitrile;9-[2-(3-cyano-2-triphenylsilylphenyl)-6-isocyanophenyl]carbazole-3-carbonitrile;3-[5-isocyano-2-(3-isocyanocarbazol-9-yl)phenyl]-2-triphenylsilylbenzonitrile?
The InChIKey is RFKXTKQYRLTOSD-UHFFFAOYSA-N. The full InChI is InChI=1S/4C45H28N4Si/c1-47-33-25-27-43-40(29-33)38-22-12-13-24-42(38)49(43)44-28-26-34(48-2)30-41(44)39-23-14-15-32(31-46)45(39)50(35-16-6-3-7-17-35,36-18-8-4-9-19-36)37-20-10-5-11-21-37;1-48-41-25-14-23-38(44(41)49-42-26-12-11-22-37(42)40-29-32(30-46)27-28-43(40)49)39-24-13-15-33(31-47)45(39)50(34-16-5-2-6-17-34,35-18-7-3-8-19-35)36-20-9-4-10-21-36;46-29-32-23-26-44-41(27-32)40-21-10-11-22-43(40)49(44)45-39(25-24-34(30-47)42(45)31-48)33-13-12-20-38(28-33)50(35-14-4-1-5-15-35,36-16-6-2-7-17-36)37-18-8-3-9-19-37;46-29-32-23-26-44-42(27-32)39-20-10-11-22-43(39)49(44)45-34(31-48)13-12-21-40(45)41-28-38(25-24-33(41)30-47)50(35-14-4-1-5-15-35,36-16-6-2-7-17-36)37-18-8-3-9-19-37/h3-30H;2-29H;2*1-28H.
What are the key properties of 3-(3-cyanocarbazol-9-yl)-4-(3-triphenylsilylphenyl)benzene-1,2-dicarbonitrile;9-[2-cyano-6-(2-cyano-5-triphenylsilylphenyl)phenyl]carbazole-3-carbonitrile;9-[2-(3-cyano-2-triphenylsilylphenyl)-6-isocyanophenyl]carbazole-3-carbonitrile;3-[5-isocyano-2-(3-isocyanocarbazol-9-yl)phenyl]-2-triphenylsilylbenzonitrile?
3-(3-cyanocarbazol-9-yl)-4-(3-triphenylsilylphenyl)benzene-1,2-dicarbonitrile;9-[2-cyano-6-(2-cyano-5-triphenylsilylphenyl)phenyl]carbazole-3-carbonitrile;9-[2-(3-cyano-2-triphenylsilylphenyl)-6-isocyanophenyl]carbazole-3-carbonitrile;3-[5-isocyano-2-(3-isocyanocarbazol-9-yl)phenyl]-2-triphenylsilylbenzonitrile has a molecular weight of 2611.33 g/mol, XLogP of 31.81, 24 rotatable bonds, 0 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-cyanocarbazol-9-yl)-4-(3-triphenylsilylphenyl)benzene-1,2-dicarbonitrile;9-[2-cyano-6-(2-cyano-5-triphenylsilylphenyl)phenyl]carbazole-3-carbonitrile;9-[2-(3-cyano-2-triphenylsilylphenyl)-6-isocyanophenyl]carbazole-3-carbonitrile;3-[5-isocyano-2-(3-isocyanocarbazol-9-yl)phenyl]-2-triphenylsilylbenzonitrile is sourced from PubChem (CID 160610331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).