diphenyl-(9-phenylcarbazol-2-yl)-[3-(5-phenylindolo[3,2-b]carbazol-11-yl)phenyl]silane

C60H41N3Si — CID 140842640

IUPACdiphenyl-(9-phenylcarbazol-2-yl)-[3-(5-phenylindolo[3,2-b]carbazol-11-yl)phenyl]silane
SMILESc1ccc(-n2c3ccccc3c3ccc([Si](c4ccccc4)(c4ccccc4)c4cccc(-n5c6ccccc6c6cc7c(cc65)c5ccccc5n7-c5ccccc5)c4)cc32)cc1
InChIInChI=1S/C60H41N3Si/c1-5-20-42(21-6-1)61-55-33-16-13-30-49(55)52-37-36-48(39-58(52)61)64(45-25-9-3-10-26-45,46-27-11-4-12-28-46)47-29-19-24-44(38-47)63-57-35-18-15-32-51(57)54-40-59-53(41-60(54)63)50-31-14-17-34-56(50)62(59)43-22-7-2-8-23-43/h1-41H
InChIKeyNNBSAWURUAYLNU-UHFFFAOYSA-N
MW832.10 g/mol
LogP12.36
Rot. Bonds7

About diphenyl-(9-phenylcarbazol-2-yl)-[3-(5-phenylindolo[3,2-b]carbazol-11-yl)phenyl]silane

diphenyl-(9-phenylcarbazol-2-yl)-[3-(5-phenylindolo[3,2-b]carbazol-11-yl)phenyl]silane (PubChem CID 140842640) has the molecular formula C60H41N3Si and a molecular weight of 832.10 g/mol. Its IUPAC name is diphenyl-(9-phenylcarbazol-2-yl)-[3-(5-phenylindolo[3,2-b]carbazol-11-yl)phenyl]silane.

Molecular Properties

Compound Namediphenyl-(9-phenylcarbazol-2-yl)-[3-(5-phenylindolo[3,2-b]carbazol-11-yl)phenyl]silane
PubChem CID140842640
Molecular FormulaC60H41N3Si
Molecular Weight832.10 g/mol
Exact Mass831.31
IUPAC Namediphenyl-(9-phenylcarbazol-2-yl)-[3-(5-phenylindolo[3,2-b]carbazol-11-yl)phenyl]silane
SMILESc1ccc(-n2c3ccccc3c3ccc([Si](c4ccccc4)(c4ccccc4)c4cccc(-n5c6ccccc6c6cc7c(cc65)c5ccccc5n7-c5ccccc5)c4)cc32)cc1
InChIInChI=1S/C60H41N3Si/c1-5-20-42(21-6-1)61-55-33-16-13-30-49(55)52-37-36-48(39-58(52)61)64(45-25-9-3-10-26-45,46-27-11-4-12-28-46)47-29-19-24-44(38-47)63-57-35-18-15-32-51(57)54-40-59-53(41-60(54)63)50-31-14-17-34-56(50)62(59)43-22-7-2-8-23-43/h1-41H
InChIKeyNNBSAWURUAYLNU-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

triphenyl-[3-[2-[2-(2-triphenylsilylcarbazol-9-yl)carbazol-9-yl]carbazol-9-yl]phenyl]silane
CID 166588700
[7-carbazol-9-yl-9-(9-phenylcarbazol-3-yl)carbazol-2-yl]-triphenylsilane
CID 170516315
(3-carbazol-9-ylphenyl)-triphenylsilane
CID 58926933
triphenyl-[3-[3-[2-(9-phenylcarbazol-2-yl)carbazol-9-yl]carbazol-9-yl]phenyl]silane
CID 166588203
(4-fluorophenyl)-diphenyl-(9-phenylcarbazol-2-yl)silane
CID 160801303
diphenyl-(9-phenylcarbazol-3-yl)-[9-(9-phenylcarbazol-3-yl)carbazol-3-yl]silane
CID 89393751
[6-(4-carbazol-9-ylphenyl)-9-phenylcarbazol-2-yl]-triphenylsilane
CID 140778740
triphenyl-[3-[3-[9-phenyl-7-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]silane
CID 140790424
[7-carbazol-9-yl-9-(9-phenylcarbazol-1-yl)carbazol-2-yl]-triphenylsilane
CID 170515020
[8-carbazol-9-yl-9-(9-phenylcarbazol-2-yl)carbazol-2-yl]-triphenylsilane
CID 170516283
triphenyl-[6-phenyl-9-(9-phenylcarbazol-3-yl)carbazol-2-yl]silane
CID 170515813
triphenyl-[3-[12-(3-triphenylsilylphenyl)indolo[2,3-a]carbazol-11-yl]phenyl]silane
CID 168792006

Frequently Asked Questions

What is the IUPAC name of diphenyl-(9-phenylcarbazol-2-yl)-[3-(5-phenylindolo[3,2-b]carbazol-11-yl)phenyl]silane?
The IUPAC name of diphenyl-(9-phenylcarbazol-2-yl)-[3-(5-phenylindolo[3,2-b]carbazol-11-yl)phenyl]silane (CID 140842640) is diphenyl-(9-phenylcarbazol-2-yl)-[3-(5-phenylindolo[3,2-b]carbazol-11-yl)phenyl]silane.
What is the SMILES notation for diphenyl-(9-phenylcarbazol-2-yl)-[3-(5-phenylindolo[3,2-b]carbazol-11-yl)phenyl]silane?
The canonical SMILES for diphenyl-(9-phenylcarbazol-2-yl)-[3-(5-phenylindolo[3,2-b]carbazol-11-yl)phenyl]silane is c1ccc(-n2c3ccccc3c3ccc([Si](c4ccccc4)(c4ccccc4)c4cccc(-n5c6ccccc6c6cc7c(cc65)c5ccccc5n7-c5ccccc5)c4)cc32)cc1.
What is the InChIKey of diphenyl-(9-phenylcarbazol-2-yl)-[3-(5-phenylindolo[3,2-b]carbazol-11-yl)phenyl]silane?
The InChIKey is NNBSAWURUAYLNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H41N3Si/c1-5-20-42(21-6-1)61-55-33-16-13-30-49(55)52-37-36-48(39-58(52)61)64(45-25-9-3-10-26-45,46-27-11-4-12-28-46)47-29-19-24-44(38-47)63-57-35-18-15-32-51(57)54-40-59-53(41-60(54)63)50-31-14-17-34-56(50)62(59)43-22-7-2-8-23-43/h1-41H.
What are the key properties of diphenyl-(9-phenylcarbazol-2-yl)-[3-(5-phenylindolo[3,2-b]carbazol-11-yl)phenyl]silane?
diphenyl-(9-phenylcarbazol-2-yl)-[3-(5-phenylindolo[3,2-b]carbazol-11-yl)phenyl]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-2-yl)-[3-(5-phenylindolo[3,2-b]carbazol-11-yl)phenyl]silane is sourced from PubChem (CID 140842640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).