triphenyl-[9-(9-phenylcarbazol-1-yl)carbazol-2-yl]silane

C48H34N2Si — CID 170515043

IUPACtriphenyl-[9-(9-phenylcarbazol-1-yl)carbazol-2-yl]silane
SMILESc1ccc(-n2c3ccccc3c3cccc(-n4c5ccccc5c5ccc([Si](c6ccccc6)(c6ccccc6)c6ccccc6)cc54)c32)cc1
InChIInChI=1S/C48H34N2Si/c1-5-18-35(19-6-1)49-44-29-15-14-27-41(44)43-28-17-31-46(48(43)49)50-45-30-16-13-26-40(45)42-33-32-39(34-47(42)50)51(36-20-7-2-8-21-36,37-22-9-3-10-23-37)38-24-11-4-12-25-38/h1-34H
InChIKeyLHUJYQXJMCVTCX-UHFFFAOYSA-N
MW666.90 g/mol
LogP9.26
Rot. Bonds6

About triphenyl-[9-(9-phenylcarbazol-1-yl)carbazol-2-yl]silane

triphenyl-[9-(9-phenylcarbazol-1-yl)carbazol-2-yl]silane (PubChem CID 170515043) has the molecular formula C48H34N2Si and a molecular weight of 666.90 g/mol. Its IUPAC name is triphenyl-[9-(9-phenylcarbazol-1-yl)carbazol-2-yl]silane.

Molecular Properties

Compound Nametriphenyl-[9-(9-phenylcarbazol-1-yl)carbazol-2-yl]silane
PubChem CID170515043
Molecular FormulaC48H34N2Si
Molecular Weight666.90 g/mol
Exact Mass666.25
IUPAC Nametriphenyl-[9-(9-phenylcarbazol-1-yl)carbazol-2-yl]silane
SMILESc1ccc(-n2c3ccccc3c3cccc(-n4c5ccccc5c5ccc([Si](c6ccccc6)(c6ccccc6)c6ccccc6)cc54)c32)cc1
InChIInChI=1S/C48H34N2Si/c1-5-18-35(19-6-1)49-44-29-15-14-27-41(44)43-28-17-31-46(48(43)49)50-45-30-16-13-26-40(45)42-33-32-39(34-47(42)50)51(36-20-7-2-8-21-36,37-22-9-3-10-23-37)38-24-11-4-12-25-38/h1-34H
InChIKeyLHUJYQXJMCVTCX-UHFFFAOYSA-N
XLogP9.26
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms51
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500666.90
LogP ≤ 59.26
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

[8-carbazol-9-yl-9-(9-phenylcarbazol-2-yl)carbazol-2-yl]-triphenylsilane
CID 170516283
[7-carbazol-9-yl-9-(9-phenylcarbazol-1-yl)carbazol-2-yl]-triphenylsilane
CID 170515020
triphenyl-[7-phenyl-9-[9-(4-phenylphenyl)carbazol-1-yl]carbazol-2-yl]silane
CID 170515983
[8-carbazol-9-yl-9-(9-phenylcarbazol-2-yl)carbazol-3-yl]-triphenylsilane
CID 170516287
[9-[8-carbazol-9-yl-9-(2-phenylphenyl)carbazol-2-yl]carbazol-2-yl]-triphenylsilane
CID 170515569
triphenyl-[3-[3-[1-(3-triphenylsilylcarbazol-9-yl)carbazol-9-yl]carbazol-9-yl]phenyl]silane
CID 166588869
bis(11,12-diphenylindolo[2,3-a]carbazol-3-yl)-diphenylsilane
CID 58489663
triphenyl-[3-[12-(3-triphenylsilylphenyl)indolo[2,3-a]carbazol-11-yl]phenyl]silane
CID 168792006
triphenyl-[4-[2-[1-(2-phenylcarbazol-9-yl)carbazol-9-yl]carbazol-9-yl]phenyl]silane
CID 166588219
diphenyl-bis[4-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]silane
CID 88576991
diphenyl-(9-phenylcarbazol-2-yl)-[3-(5-phenylindolo[3,2-b]carbazol-11-yl)phenyl]silane
CID 140842640
triphenyl-[9-[9-[3-(3-phenylphenyl)phenyl]carbazol-1-yl]carbazol-3-yl]silane
CID 170515471

Frequently Asked Questions

What is the IUPAC name of triphenyl-[9-(9-phenylcarbazol-1-yl)carbazol-2-yl]silane?
The IUPAC name of triphenyl-[9-(9-phenylcarbazol-1-yl)carbazol-2-yl]silane (CID 170515043) is triphenyl-[9-(9-phenylcarbazol-1-yl)carbazol-2-yl]silane.
What is the SMILES notation for triphenyl-[9-(9-phenylcarbazol-1-yl)carbazol-2-yl]silane?
The canonical SMILES for triphenyl-[9-(9-phenylcarbazol-1-yl)carbazol-2-yl]silane is c1ccc(-n2c3ccccc3c3cccc(-n4c5ccccc5c5ccc([Si](c6ccccc6)(c6ccccc6)c6ccccc6)cc54)c32)cc1.
What is the InChIKey of triphenyl-[9-(9-phenylcarbazol-1-yl)carbazol-2-yl]silane?
The InChIKey is LHUJYQXJMCVTCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H34N2Si/c1-5-18-35(19-6-1)49-44-29-15-14-27-41(44)43-28-17-31-46(48(43)49)50-45-30-16-13-26-40(45)42-33-32-39(34-47(42)50)51(36-20-7-2-8-21-36,37-22-9-3-10-23-37)38-24-11-4-12-25-38/h1-34H.
What are the key properties of triphenyl-[9-(9-phenylcarbazol-1-yl)carbazol-2-yl]silane?
triphenyl-[9-(9-phenylcarbazol-1-yl)carbazol-2-yl]silane has a molecular weight of 666.90 g/mol, XLogP of 9.26, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for triphenyl-[9-(9-phenylcarbazol-1-yl)carbazol-2-yl]silane is sourced from PubChem (CID 170515043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).