triphenyl-[6-phenyl-9-(9-phenylcarbazol-3-yl)carbazol-2-yl]silane

C54H38N2Si — CID 170515813

IUPACtriphenyl-[6-phenyl-9-(9-phenylcarbazol-3-yl)carbazol-2-yl]silane
SMILESc1ccc(-c2ccc3c(c2)c2ccc([Si](c4ccccc4)(c4ccccc4)c4ccccc4)cc2n3-c2ccc3c(c2)c2ccccc2n3-c2ccccc2)cc1
InChIInChI=1S/C54H38N2Si/c1-6-18-39(19-7-1)40-30-34-52-49(36-40)48-33-32-46(57(43-22-10-3-11-23-43,44-24-12-4-13-25-44)45-26-14-5-15-27-45)38-54(48)56(52)42-31-35-53-50(37-42)47-28-16-17-29-51(47)55(53)41-20-8-2-9-21-41/h1-38H
InChIKeyOFALJNVJZQEQJT-UHFFFAOYSA-N
MW743.00 g/mol
LogP10.93
Rot. Bonds7

About triphenyl-[6-phenyl-9-(9-phenylcarbazol-3-yl)carbazol-2-yl]silane

triphenyl-[6-phenyl-9-(9-phenylcarbazol-3-yl)carbazol-2-yl]silane (PubChem CID 170515813) has the molecular formula C54H38N2Si and a molecular weight of 743.00 g/mol. Its IUPAC name is triphenyl-[6-phenyl-9-(9-phenylcarbazol-3-yl)carbazol-2-yl]silane.

Molecular Properties

Compound Nametriphenyl-[6-phenyl-9-(9-phenylcarbazol-3-yl)carbazol-2-yl]silane
PubChem CID170515813
Molecular FormulaC54H38N2Si
Molecular Weight743.00 g/mol
Exact Mass742.28
IUPAC Nametriphenyl-[6-phenyl-9-(9-phenylcarbazol-3-yl)carbazol-2-yl]silane
SMILESc1ccc(-c2ccc3c(c2)c2ccc([Si](c4ccccc4)(c4ccccc4)c4ccccc4)cc2n3-c2ccc3c(c2)c2ccccc2n3-c2ccccc2)cc1
InChIInChI=1S/C54H38N2Si/c1-6-18-39(19-7-1)40-30-34-52-49(36-40)48-33-32-46(57(43-22-10-3-11-23-43,44-24-12-4-13-25-44)45-26-14-5-15-27-45)38-54(48)56(52)42-31-35-53-50(37-42)47-28-16-17-29-51(47)55(53)41-20-8-2-9-21-41/h1-38H
InChIKeyOFALJNVJZQEQJT-UHFFFAOYSA-N
XLogP10.93
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms57
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500743.00
LogP ≤ 510.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

[6-(4-carbazol-9-ylphenyl)-9-phenylcarbazol-2-yl]-triphenylsilane
CID 140778740
triphenyl-[6-(2-phenylcarbazol-9-yl)-9-(9-phenylcarbazol-3-yl)carbazol-3-yl]silane
CID 170516502
triphenyl-[3-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]silane
CID 147032702
[9-[7-carbazol-9-yl-9-(4-phenylphenyl)carbazol-2-yl]carbazol-3-yl]-triphenylsilane
CID 170515024
[7-carbazol-9-yl-9-(9-phenylcarbazol-3-yl)carbazol-2-yl]-triphenylsilane
CID 170516315
triphenyl-[4-[3-[4-(9-phenylcarbazol-3-yl)phenyl]carbazol-9-yl]phenyl]silane
CID 140782739
9-phenyl-3-[3-(9-phenylcarbazol-3-yl)phenyl]carbazole;9-phenyl-3-[4-(9-phenylcarbazol-3-yl)phenyl]carbazole;triphenyl-[3-[3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-2-yl]phenyl]phenyl]silane;triphenyl-[4-[3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-2-yl]phenyl]phenyl]silane;triphenyl-[9-phenyl-6-[9-phenyl-7-(3-phenylphenyl)carbazol-3-yl]carbazol-2-yl]silane;triphenyl-[9-phenyl-6-[9-phenyl-7-(3-phenylphenyl)carbazol-3-yl]carbazol-3-yl]silane
CID 165026988
triphenyl-[3-[3-[9-phenyl-7-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]silane
CID 140790424
triphenyl-[3-[3-[3-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]carbazol-9-yl]phenyl]phenyl]silane
CID 140782755
triphenyl-[3-[3-[2-(9-phenylcarbazol-2-yl)carbazol-9-yl]carbazol-9-yl]phenyl]silane
CID 166588203
triphenyl-[9-phenyl-6-[9-[4-(3-phenylphenyl)phenyl]carbazol-3-yl]carbazol-3-yl]silane
CID 140790437
[9-[9-(2,5-diphenylphenyl)carbazol-3-yl]carbazol-2-yl]-triphenylsilane
CID 170514986

Frequently Asked Questions

What is the IUPAC name of triphenyl-[6-phenyl-9-(9-phenylcarbazol-3-yl)carbazol-2-yl]silane?
The IUPAC name of triphenyl-[6-phenyl-9-(9-phenylcarbazol-3-yl)carbazol-2-yl]silane (CID 170515813) is triphenyl-[6-phenyl-9-(9-phenylcarbazol-3-yl)carbazol-2-yl]silane.
What is the SMILES notation for triphenyl-[6-phenyl-9-(9-phenylcarbazol-3-yl)carbazol-2-yl]silane?
The canonical SMILES for triphenyl-[6-phenyl-9-(9-phenylcarbazol-3-yl)carbazol-2-yl]silane is c1ccc(-c2ccc3c(c2)c2ccc([Si](c4ccccc4)(c4ccccc4)c4ccccc4)cc2n3-c2ccc3c(c2)c2ccccc2n3-c2ccccc2)cc1.
What is the InChIKey of triphenyl-[6-phenyl-9-(9-phenylcarbazol-3-yl)carbazol-2-yl]silane?
The InChIKey is OFALJNVJZQEQJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H38N2Si/c1-6-18-39(19-7-1)40-30-34-52-49(36-40)48-33-32-46(57(43-22-10-3-11-23-43,44-24-12-4-13-25-44)45-26-14-5-15-27-45)38-54(48)56(52)42-31-35-53-50(37-42)47-28-16-17-29-51(47)55(53)41-20-8-2-9-21-41/h1-38H.
What are the key properties of triphenyl-[6-phenyl-9-(9-phenylcarbazol-3-yl)carbazol-2-yl]silane?
triphenyl-[6-phenyl-9-(9-phenylcarbazol-3-yl)carbazol-2-yl]silane has a molecular weight of 743.00 g/mol, XLogP of 10.93, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for triphenyl-[6-phenyl-9-(9-phenylcarbazol-3-yl)carbazol-2-yl]silane is sourced from PubChem (CID 170515813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).