diphenyl-(9-phenylcarbazol-4-yl)-(6-phenyl-2-pyridinyl)silane

C41H30N2Si — CID 160942076

IUPACdiphenyl-(9-phenylcarbazol-4-yl)-(6-phenyl-2-pyridinyl)silane
SMILESc1ccc(-c2cccc([Si](c3ccccc3)(c3ccccc3)c3cccc4c3c3ccccc3n4-c3ccccc3)n2)cc1
InChIInChI=1S/C41H30N2Si/c1-5-17-31(18-6-1)36-26-15-30-40(42-36)44(33-21-9-3-10-22-33,34-23-11-4-12-24-34)39-29-16-28-38-41(39)35-25-13-14-27-37(35)43(38)32-19-7-2-8-20-32/h1-30H
InChIKeyVFTBWAUFSUOEED-UHFFFAOYSA-N
MW578.79 g/mol
LogP7.22
Rot. Bonds6

About diphenyl-(9-phenylcarbazol-4-yl)-(6-phenyl-2-pyridinyl)silane

diphenyl-(9-phenylcarbazol-4-yl)-(6-phenyl-2-pyridinyl)silane (PubChem CID 160942076) has the molecular formula C41H30N2Si and a molecular weight of 578.79 g/mol. Its IUPAC name is diphenyl-(9-phenylcarbazol-4-yl)-(6-phenyl-2-pyridinyl)silane.

Molecular Properties

Compound Namediphenyl-(9-phenylcarbazol-4-yl)-(6-phenyl-2-pyridinyl)silane
PubChem CID160942076
Molecular FormulaC41H30N2Si
Molecular Weight578.79 g/mol
Exact Mass578.22
IUPAC Namediphenyl-(9-phenylcarbazol-4-yl)-(6-phenyl-2-pyridinyl)silane
SMILESc1ccc(-c2cccc([Si](c3ccccc3)(c3ccccc3)c3cccc4c3c3ccccc3n4-c3ccccc3)n2)cc1
InChIInChI=1S/C41H30N2Si/c1-5-17-31(18-6-1)36-26-15-30-40(42-36)44(33-21-9-3-10-22-33,34-23-11-4-12-24-34)39-29-16-28-38-41(39)35-25-13-14-27-37(35)43(38)32-19-7-2-8-20-32/h1-30H
InChIKeyVFTBWAUFSUOEED-UHFFFAOYSA-N
XLogP7.22
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms44
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500578.79
LogP ≤ 57.22
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

triphenyl-[9-(9-phenylcarbazol-4-yl)carbazol-4-yl]silane
CID 170515887
[3,5-di(carbazol-9-yl)phenyl]-diphenyl-(9-phenylcarbazol-4-yl)silane
CID 158933010
triphenyl-[8-phenyl-9-(9-phenylcarbazol-4-yl)carbazol-4-yl]silane
CID 170516087
[9-(5,9-diphenylcarbazol-4-yl)carbazol-4-yl]-triphenylsilane
CID 170516212
4-[diphenyl-(9-phenylcarbazol-4-yl)silyl]-N,N-diphenylaniline
CID 158876574
[6-carbazol-9-yl-9-(4-phenylphenyl)carbazol-4-yl]-triphenylsilane
CID 171458247
[8-carbazol-9-yl-9-(9-phenylcarbazol-4-yl)carbazol-4-yl]-triphenylsilane
CID 170515814
triphenyl-[6-[2-(9-phenylcarbazol-3-yl)phenyl]-2-pyridinyl]silane
CID 144577449
diphenyl-(3-phenylphenyl)-[9-[9-[3-(3-phenylphenyl)phenyl]carbazol-3-yl]carbazol-4-yl]silane
CID 171458393
(3-carbazol-9-ylphenyl)-diphenyl-[9-[9-[3-(3-phenylphenyl)phenyl]carbazol-3-yl]carbazol-4-yl]silane
CID 171458575
(3-carbazol-9-ylphenyl)-[3-[3-[4-[diphenyl-(3-phenylphenyl)silyl]carbazol-9-yl]carbazol-9-yl]phenyl]-diphenylsilane
CID 171458462
triphenyl-[6-(4-phenylcarbazol-9-yl)-9-(4-phenylphenyl)carbazol-4-yl]silane
CID 171457929

Frequently Asked Questions

What is the IUPAC name of diphenyl-(9-phenylcarbazol-4-yl)-(6-phenyl-2-pyridinyl)silane?
The IUPAC name of diphenyl-(9-phenylcarbazol-4-yl)-(6-phenyl-2-pyridinyl)silane (CID 160942076) is diphenyl-(9-phenylcarbazol-4-yl)-(6-phenyl-2-pyridinyl)silane.
What is the SMILES notation for diphenyl-(9-phenylcarbazol-4-yl)-(6-phenyl-2-pyridinyl)silane?
The canonical SMILES for diphenyl-(9-phenylcarbazol-4-yl)-(6-phenyl-2-pyridinyl)silane is c1ccc(-c2cccc([Si](c3ccccc3)(c3ccccc3)c3cccc4c3c3ccccc3n4-c3ccccc3)n2)cc1.
What is the InChIKey of diphenyl-(9-phenylcarbazol-4-yl)-(6-phenyl-2-pyridinyl)silane?
The InChIKey is VFTBWAUFSUOEED-UHFFFAOYSA-N. The full InChI is InChI=1S/C41H30N2Si/c1-5-17-31(18-6-1)36-26-15-30-40(42-36)44(33-21-9-3-10-22-33,34-23-11-4-12-24-34)39-29-16-28-38-41(39)35-25-13-14-27-37(35)43(38)32-19-7-2-8-20-32/h1-30H.
What are the key properties of diphenyl-(9-phenylcarbazol-4-yl)-(6-phenyl-2-pyridinyl)silane?
diphenyl-(9-phenylcarbazol-4-yl)-(6-phenyl-2-pyridinyl)silane has a molecular weight of 578.79 g/mol, XLogP of 7.22, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for diphenyl-(9-phenylcarbazol-4-yl)-(6-phenyl-2-pyridinyl)silane is sourced from PubChem (CID 160942076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).