3-[3-[3-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]benzonitrile;triphenyl-[3-[3-[3-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]phenyl]silane;triphenyl-[4-[3-[3-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]phenyl]silane

C181H123N7Si2 — CID 163423983

IUPAC3-[3-[3-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]benzonitrile;triphenyl-[3-[3-[3-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]phenyl]silane;triphenyl-[4-[3-[3-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]phenyl]silane
SMILESN#Cc1cccc(-c2cccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5cccc(-c6ccccc6)c5)ccc43)c2)c1.c1ccc(-c2cccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5cccc(-c6ccc([Si](c7ccccc7)(c7ccccc7)c7ccccc7)cc6)c5)ccc43)c2)cc1.c1ccc(-c2cccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5cccc(-c6cccc([Si](c7ccccc7)(c7ccccc7)c7ccccc7)c6)c5)ccc43)c2)cc1
InChIInChI=1S/2C66H46N2Si.C49H31N3/c1-5-20-47(21-6-1)48-22-17-25-53(42-48)67-63-36-15-13-34-59(63)61-45-51(38-40-65(61)67)52-39-41-66-62(46-52)60-35-14-16-37-64(60)68(66)54-26-18-23-49(43-54)50-24-19-33-58(44-50)69(55-27-7-2-8-28-55,56-29-9-3-10-30-56)57-31-11-4-12-32-57;1-5-19-47(20-6-1)49-21-17-23-53(43-49)67-63-33-15-13-31-59(63)61-45-51(37-41-65(61)67)52-38-42-66-62(46-52)60-32-14-16-34-64(60)68(66)54-24-18-22-50(44-54)48-35-39-58(40-36-48)69(55-25-7-2-8-26-55,56-27-9-3-10-28-56)57-29-11-4-12-30-57;50-32-33-11-8-14-35(27-33)37-16-10-18-41(29-37)52-47-22-7-5-20-43(47)45-31-39(24-26-49(45)52)38-23-25-48-44(30-38)42-19-4-6-21-46(42)51(48)40-17-9-15-36(28-40)34-12-2-1-3-13-34/h2*1-46H;1-31H
InChIKeyAKWYXZUVHGAFRX-UHFFFAOYSA-N
MW2452.20 g/mol
LogP41.27
Rot. Bonds23

About 3-[3-[3-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]benzonitrile;triphenyl-[3-[3-[3-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]phenyl]silane;triphenyl-[4-[3-[3-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]phenyl]silane

3-[3-[3-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]benzonitrile;triphenyl-[3-[3-[3-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]phenyl]silane;triphenyl-[4-[3-[3-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]phenyl]silane (PubChem CID 163423983) has the molecular formula C181H123N7Si2 and a molecular weight of 2452.20 g/mol. Its IUPAC name is 3-[3-[3-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]benzonitrile;triphenyl-[3-[3-[3-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]phenyl]silane;triphenyl-[4-[3-[3-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]phenyl]silane.

Molecular Properties

Compound Name3-[3-[3-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]benzonitrile;triphenyl-[3-[3-[3-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]phenyl]silane;triphenyl-[4-[3-[3-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]phenyl]silane
PubChem CID163423983
Molecular FormulaC181H123N7Si2
Molecular Weight2452.20 g/mol
Exact Mass2449.94
IUPAC Name3-[3-[3-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]benzonitrile;triphenyl-[3-[3-[3-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]phenyl]silane;triphenyl-[4-[3-[3-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]phenyl]silane
SMILESN#Cc1cccc(-c2cccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5cccc(-c6ccccc6)c5)ccc43)c2)c1.c1ccc(-c2cccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5cccc(-c6ccc([Si](c7ccccc7)(c7ccccc7)c7ccccc7)cc6)c5)ccc43)c2)cc1.c1ccc(-c2cccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5cccc(-c6cccc([Si](c7ccccc7)(c7ccccc7)c7ccccc7)c6)c5)ccc43)c2)cc1
InChIInChI=1S/2C66H46N2Si.C49H31N3/c1-5-20-47(21-6-1)48-22-17-25-53(42-48)67-63-36-15-13-34-59(63)61-45-51(38-40-65(61)67)52-39-41-66-62(46-52)60-35-14-16-37-64(60)68(66)54-26-18-23-49(43-54)50-24-19-33-58(44-50)69(55-27-7-2-8-28-55,56-29-9-3-10-30-56)57-31-11-4-12-32-57;1-5-19-47(20-6-1)49-21-17-23-53(43-49)67-63-33-15-13-31-59(63)61-45-51(37-41-65(61)67)52-38-42-66-62(46-52)60-32-14-16-34-64(60)68(66)54-24-18-22-50(44-54)48-35-39-58(40-36-48)69(55-25-7-2-8-26-55,56-27-9-3-10-28-56)57-29-11-4-12-30-57;50-32-33-11-8-14-35(27-33)37-16-10-18-41(29-37)52-47-22-7-5-20-43(47)45-31-39(24-26-49(45)52)38-23-25-48-44(30-38)42-19-4-6-21-46(42)51(48)40-17-9-15-36(28-40)34-12-2-1-3-13-34/h2*1-46H;1-31H
InChIKeyAKWYXZUVHGAFRX-UHFFFAOYSA-N
XLogP41.27
TPSA53.37 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds23
Heavy Atoms190
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002452.20
LogP ≤ 541.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

Analyze 3-[3-[3-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]benzonitrile;triphenyl-[3-[3-[3-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]phenyl]silane;triphenyl-[4-[3-[3-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]phenyl]silane with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3-[3-[3-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]benzonitrile;triphenyl-[3-[3-[3-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]phenyl]silane;triphenyl-[4-[3-[3-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]phenyl]silane?
The IUPAC name of 3-[3-[3-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]benzonitrile;triphenyl-[3-[3-[3-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]phenyl]silane;triphenyl-[4-[3-[3-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]phenyl]silane (CID 163423983) is 3-[3-[3-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]benzonitrile;triphenyl-[3-[3-[3-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]phenyl]silane;triphenyl-[4-[3-[3-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]phenyl]silane.
What is the SMILES notation for 3-[3-[3-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]benzonitrile;triphenyl-[3-[3-[3-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]phenyl]silane;triphenyl-[4-[3-[3-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]phenyl]silane?
The canonical SMILES for 3-[3-[3-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]benzonitrile;triphenyl-[3-[3-[3-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]phenyl]silane;triphenyl-[4-[3-[3-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]phenyl]silane is N#Cc1cccc(-c2cccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5cccc(-c6ccccc6)c5)ccc43)c2)c1.c1ccc(-c2cccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5cccc(-c6ccc([Si](c7ccccc7)(c7ccccc7)c7ccccc7)cc6)c5)ccc43)c2)cc1.c1ccc(-c2cccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5cccc(-c6cccc([Si](c7ccccc7)(c7ccccc7)c7ccccc7)c6)c5)ccc43)c2)cc1.
What is the InChIKey of 3-[3-[3-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]benzonitrile;triphenyl-[3-[3-[3-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]phenyl]silane;triphenyl-[4-[3-[3-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]phenyl]silane?
The InChIKey is AKWYXZUVHGAFRX-UHFFFAOYSA-N. The full InChI is InChI=1S/2C66H46N2Si.C49H31N3/c1-5-20-47(21-6-1)48-22-17-25-53(42-48)67-63-36-15-13-34-59(63)61-45-51(38-40-65(61)67)52-39-41-66-62(46-52)60-35-14-16-37-64(60)68(66)54-26-18-23-49(43-54)50-24-19-33-58(44-50)69(55-27-7-2-8-28-55,56-29-9-3-10-30-56)57-31-11-4-12-32-57;1-5-19-47(20-6-1)49-21-17-23-53(43-49)67-63-33-15-13-31-59(63)61-45-51(37-41-65(61)67)52-38-42-66-62(46-52)60-32-14-16-34-64(60)68(66)54-24-18-22-50(44-54)48-35-39-58(40-36-48)69(55-25-7-2-8-26-55,56-27-9-3-10-28-56)57-29-11-4-12-30-57;50-32-33-11-8-14-35(27-33)37-16-10-18-41(29-37)52-47-22-7-5-20-43(47)45-31-39(24-26-49(45)52)38-23-25-48-44(30-38)42-19-4-6-21-46(42)51(48)40-17-9-15-36(28-40)34-12-2-1-3-13-34/h2*1-46H;1-31H.
What are the key properties of 3-[3-[3-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]benzonitrile;triphenyl-[3-[3-[3-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]phenyl]silane;triphenyl-[4-[3-[3-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]phenyl]silane?
3-[3-[3-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]benzonitrile;triphenyl-[3-[3-[3-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]phenyl]silane;triphenyl-[4-[3-[3-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]phenyl]silane has a molecular weight of 2452.20 g/mol, XLogP of 41.27, 23 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-[3-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]benzonitrile;triphenyl-[3-[3-[3-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]phenyl]silane;triphenyl-[4-[3-[3-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]phenyl]silane is sourced from PubChem (CID 163423983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).