[4-[5-(3,6-diphenylcarbazol-9-yl)naphthalen-1-yl]phenyl]-triphenylsilane

C58H41NSi — CID 59372180

IUPAC[4-[5-(3,6-diphenylcarbazol-9-yl)naphthalen-1-yl]phenyl]-triphenylsilane
SMILESc1ccc(-c2ccc3c(c2)c2cc(-c4ccccc4)ccc2n3-c2cccc3c(-c4ccc([Si](c5ccccc5)(c5ccccc5)c5ccccc5)cc4)cccc23)cc1
InChIInChI=1S/C58H41NSi/c1-6-18-42(19-7-1)45-34-38-57-54(40-45)55-41-46(43-20-8-2-9-21-43)35-39-58(55)59(57)56-31-17-29-52-51(28-16-30-53(52)56)44-32-36-50(37-33-44)60(47-22-10-3-11-23-47,48-24-12-4-13-25-48)49-26-14-5-15-27-49/h1-41H
InChIKeyRCYCTBPSIQRCTR-UHFFFAOYSA-N
MW780.06 g/mol
LogP12.32
Rot. Bonds8

About [4-[5-(3,6-diphenylcarbazol-9-yl)naphthalen-1-yl]phenyl]-triphenylsilane

[4-[5-(3,6-diphenylcarbazol-9-yl)naphthalen-1-yl]phenyl]-triphenylsilane (PubChem CID 59372180) has the molecular formula C58H41NSi and a molecular weight of 780.06 g/mol. Its IUPAC name is [4-[5-(3,6-diphenylcarbazol-9-yl)naphthalen-1-yl]phenyl]-triphenylsilane.

Molecular Properties

Compound Name[4-[5-(3,6-diphenylcarbazol-9-yl)naphthalen-1-yl]phenyl]-triphenylsilane
PubChem CID59372180
Molecular FormulaC58H41NSi
Molecular Weight780.06 g/mol
Exact Mass779.30
IUPAC Name[4-[5-(3,6-diphenylcarbazol-9-yl)naphthalen-1-yl]phenyl]-triphenylsilane
SMILESc1ccc(-c2ccc3c(c2)c2cc(-c4ccccc4)ccc2n3-c2cccc3c(-c4ccc([Si](c5ccccc5)(c5ccccc5)c5ccccc5)cc4)cccc23)cc1
InChIInChI=1S/C58H41NSi/c1-6-18-42(19-7-1)45-34-38-57-54(40-45)55-41-46(43-20-8-2-9-21-43)35-39-58(55)59(57)56-31-17-29-52-51(28-16-30-53(52)56)44-32-36-50(37-33-44)60(47-22-10-3-11-23-47,48-24-12-4-13-25-48)49-26-14-5-15-27-49/h1-41H
InChIKeyRCYCTBPSIQRCTR-UHFFFAOYSA-N
XLogP12.32
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms60
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500780.06
LogP ≤ 512.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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

triphenyl-[3-[2-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]phenyl]silane
CID 169290688
triphenyl-[6-phenyl-9-[9-(2-phenylphenyl)carbazol-2-yl]carbazol-3-yl]silane
CID 170515246
triphenyl-[9-[6-phenyl-9-(2-phenylphenyl)carbazol-2-yl]carbazol-2-yl]silane
CID 170515763
[4-[3-[9-(2,6-diphenylphenyl)carbazol-3-yl]carbazol-9-yl]-3,5-diphenylphenyl]-diphenyl-(4-phenylphenyl)silane
CID 168762556
3-[9-(2-phenylphenyl)carbazol-3-yl]-9-[2-[4-[4-[3-[3-[4-(4-phenylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]carbazole
CID 154590713
(3,5-diphenylphenyl)-[3,5-diphenyl-4-[3-[9-(2-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]-diphenylsilane
CID 168762444
[3-[4-(2-carbazol-9-ylphenyl)-6-(3-phenylcarbazol-9-yl)-1,3,5-triazin-2-yl]phenyl]-phenyl-bis(3-phenylphenyl)silane
CID 168836386
[4-[3-[9-(2,6-diphenylphenyl)carbazol-3-yl]carbazol-9-yl]-3,5-diphenylphenyl]-triphenylsilane
CID 168762506
triphenyl-[4-[4-[3-(3-phenylcarbazol-9-yl)carbazol-9-yl]carbazol-9-yl]phenyl]silane
CID 166588633
3-(9-naphthalen-1-ylcarbazol-3-yl)-9-(4-phenylnaphthalen-1-yl)carbazole
CID 118581890
[4-[3-[2-(3-carbazol-9-ylcarbazol-9-yl)phenyl]carbazol-9-yl]-3,5-diphenylphenyl]-diphenyl-(3-phenylphenyl)silane
CID 168762463
[3-[3-(2-carbazol-9-ylphenyl)carbazol-9-yl]phenyl]-triphenylsilane
CID 162490205

Frequently Asked Questions

What is the IUPAC name of [4-[5-(3,6-diphenylcarbazol-9-yl)naphthalen-1-yl]phenyl]-triphenylsilane?
The IUPAC name of [4-[5-(3,6-diphenylcarbazol-9-yl)naphthalen-1-yl]phenyl]-triphenylsilane (CID 59372180) is [4-[5-(3,6-diphenylcarbazol-9-yl)naphthalen-1-yl]phenyl]-triphenylsilane.
What is the SMILES notation for [4-[5-(3,6-diphenylcarbazol-9-yl)naphthalen-1-yl]phenyl]-triphenylsilane?
The canonical SMILES for [4-[5-(3,6-diphenylcarbazol-9-yl)naphthalen-1-yl]phenyl]-triphenylsilane is c1ccc(-c2ccc3c(c2)c2cc(-c4ccccc4)ccc2n3-c2cccc3c(-c4ccc([Si](c5ccccc5)(c5ccccc5)c5ccccc5)cc4)cccc23)cc1.
What is the InChIKey of [4-[5-(3,6-diphenylcarbazol-9-yl)naphthalen-1-yl]phenyl]-triphenylsilane?
The InChIKey is RCYCTBPSIQRCTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C58H41NSi/c1-6-18-42(19-7-1)45-34-38-57-54(40-45)55-41-46(43-20-8-2-9-21-43)35-39-58(55)59(57)56-31-17-29-52-51(28-16-30-53(52)56)44-32-36-50(37-33-44)60(47-22-10-3-11-23-47,48-24-12-4-13-25-48)49-26-14-5-15-27-49/h1-41H.
What are the key properties of [4-[5-(3,6-diphenylcarbazol-9-yl)naphthalen-1-yl]phenyl]-triphenylsilane?
[4-[5-(3,6-diphenylcarbazol-9-yl)naphthalen-1-yl]phenyl]-triphenylsilane has a molecular weight of 780.06 g/mol, XLogP of 12.32, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[5-(3,6-diphenylcarbazol-9-yl)naphthalen-1-yl]phenyl]-triphenylsilane is sourced from PubChem (CID 59372180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).