diphenyl-(9-phenylcarbazol-3-yl)-[9-(9-phenylcarbazol-3-yl)carbazol-3-yl]silane

C60H41N3Si — CID 89393751

IUPACdiphenyl-(9-phenylcarbazol-3-yl)-[9-(9-phenylcarbazol-3-yl)carbazol-3-yl]silane
SMILESc1ccc(-n2c3ccccc3c3cc(-n4c5ccccc5c5cc([Si](c6ccccc6)(c6ccccc6)c6ccc7c(c6)c6ccccc6n7-c6ccccc6)ccc54)ccc32)cc1
InChIInChI=1S/C60H41N3Si/c1-5-19-42(20-6-1)61-55-30-16-13-27-49(55)52-39-44(33-36-58(52)61)63-57-32-18-15-29-51(57)54-41-48(35-38-60(54)63)64(45-23-9-3-10-24-45,46-25-11-4-12-26-46)47-34-37-59-53(40-47)50-28-14-17-31-56(50)62(59)43-21-7-2-8-22-43/h1-41H
InChIKeyFDMRRVWFPAWQDO-UHFFFAOYSA-N
MW832.10 g/mol
LogP12.36
Rot. Bonds7

About diphenyl-(9-phenylcarbazol-3-yl)-[9-(9-phenylcarbazol-3-yl)carbazol-3-yl]silane

diphenyl-(9-phenylcarbazol-3-yl)-[9-(9-phenylcarbazol-3-yl)carbazol-3-yl]silane (PubChem CID 89393751) has the molecular formula C60H41N3Si and a molecular weight of 832.10 g/mol. Its IUPAC name is diphenyl-(9-phenylcarbazol-3-yl)-[9-(9-phenylcarbazol-3-yl)carbazol-3-yl]silane.

Molecular Properties

Compound Namediphenyl-(9-phenylcarbazol-3-yl)-[9-(9-phenylcarbazol-3-yl)carbazol-3-yl]silane
PubChem CID89393751
Molecular FormulaC60H41N3Si
Molecular Weight832.10 g/mol
Exact Mass831.31
IUPAC Namediphenyl-(9-phenylcarbazol-3-yl)-[9-(9-phenylcarbazol-3-yl)carbazol-3-yl]silane
SMILESc1ccc(-n2c3ccccc3c3cc(-n4c5ccccc5c5cc([Si](c6ccccc6)(c6ccccc6)c6ccc7c(c6)c6ccccc6n7-c6ccccc6)ccc54)ccc32)cc1
InChIInChI=1S/C60H41N3Si/c1-5-19-42(20-6-1)61-55-30-16-13-27-49(55)52-39-44(33-36-58(52)61)63-57-32-18-15-29-51(57)54-41-48(35-38-60(54)63)64(45-23-9-3-10-24-45,46-25-11-4-12-26-46)47-34-37-59-53(40-47)50-28-14-17-31-56(50)62(59)43-21-7-2-8-22-43/h1-41H
InChIKeyFDMRRVWFPAWQDO-UHFFFAOYSA-N
XLogP12.36
TPSA14.79 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms64
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500832.10
LogP ≤ 512.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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

[4-[3,6-di(carbazol-9-yl)carbazol-9-yl]phenyl]-triphenylsilane
CID 159773868
[7-carbazol-9-yl-9-(9-phenylcarbazol-3-yl)carbazol-2-yl]-triphenylsilane
CID 170516315
[3-(3-carbazol-9-ylcarbazol-9-yl)phenyl]-triphenylsilane;[3-(3-carbazol-9-yl-6-trimethylsilylcarbazol-9-yl)phenyl]-triphenylsilane;[3-(3-carbazol-9-yl-6-triphenylsilylcarbazol-9-yl)phenyl]-triphenylsilane
CID 165013153
triphenyl-[6-(2-phenylcarbazol-9-yl)-9-(9-phenylcarbazol-3-yl)carbazol-3-yl]silane
CID 170516502
(4-methylphenyl)-diphenyl-(9-phenylcarbazol-3-yl)silane
CID 158052706
[9-(4-methylphenyl)carbazol-3-yl]-triphenylsilane
CID 168811108
[9-[7-carbazol-9-yl-9-(4-phenylphenyl)carbazol-2-yl]carbazol-3-yl]-triphenylsilane
CID 170515024
[9-[2-carbazol-9-yl-6-(3-carbazol-9-ylcarbazol-9-yl)-4-pyridinyl]carbazol-3-yl]-triphenylsilane
CID 169052984
(30-carbazol-9-yl-8,26-diazanonacyclo[24.10.1.18,15.02,7.09,14.020,25.027,32.033,37.019,38]octatriaconta-1(37),2,4,6,9(14),10,12,15,17,19(38),20,22,24,27(32),28,30,33,35-octadecaen-12-yl)-triphenylsilane
CID 168811390
bis(4-carbazol-9-ylphenyl)-diphenylsilane
CID 139043550
triphenyl-[3-[3-[1-(3-triphenylsilylcarbazol-9-yl)carbazol-9-yl]carbazol-9-yl]phenyl]silane
CID 166588869
triphenyl-[6-phenyl-9-(9-phenylcarbazol-3-yl)carbazol-2-yl]silane
CID 170515813

Frequently Asked Questions

What is the IUPAC name of diphenyl-(9-phenylcarbazol-3-yl)-[9-(9-phenylcarbazol-3-yl)carbazol-3-yl]silane?
The IUPAC name of diphenyl-(9-phenylcarbazol-3-yl)-[9-(9-phenylcarbazol-3-yl)carbazol-3-yl]silane (CID 89393751) is diphenyl-(9-phenylcarbazol-3-yl)-[9-(9-phenylcarbazol-3-yl)carbazol-3-yl]silane.
What is the SMILES notation for diphenyl-(9-phenylcarbazol-3-yl)-[9-(9-phenylcarbazol-3-yl)carbazol-3-yl]silane?
The canonical SMILES for diphenyl-(9-phenylcarbazol-3-yl)-[9-(9-phenylcarbazol-3-yl)carbazol-3-yl]silane is c1ccc(-n2c3ccccc3c3cc(-n4c5ccccc5c5cc([Si](c6ccccc6)(c6ccccc6)c6ccc7c(c6)c6ccccc6n7-c6ccccc6)ccc54)ccc32)cc1.
What is the InChIKey of diphenyl-(9-phenylcarbazol-3-yl)-[9-(9-phenylcarbazol-3-yl)carbazol-3-yl]silane?
The InChIKey is FDMRRVWFPAWQDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H41N3Si/c1-5-19-42(20-6-1)61-55-30-16-13-27-49(55)52-39-44(33-36-58(52)61)63-57-32-18-15-29-51(57)54-41-48(35-38-60(54)63)64(45-23-9-3-10-24-45,46-25-11-4-12-26-46)47-34-37-59-53(40-47)50-28-14-17-31-56(50)62(59)43-21-7-2-8-22-43/h1-41H.
What are the key properties of diphenyl-(9-phenylcarbazol-3-yl)-[9-(9-phenylcarbazol-3-yl)carbazol-3-yl]silane?
diphenyl-(9-phenylcarbazol-3-yl)-[9-(9-phenylcarbazol-3-yl)carbazol-3-yl]silane has a molecular weight of 832.10 g/mol, XLogP of 12.36, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for diphenyl-(9-phenylcarbazol-3-yl)-[9-(9-phenylcarbazol-3-yl)carbazol-3-yl]silane is sourced from PubChem (CID 89393751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).