diphenyl-(11-phenyl-12-pyridin-2-ylindolo[2,3-a]carbazol-2-yl)-(3-pyridin-2-ylphenyl)silane

C52H36N4Si — CID 140951427

IUPACdiphenyl-(11-phenyl-12-pyridin-2-ylindolo[2,3-a]carbazol-2-yl)-(3-pyridin-2-ylphenyl)silane
SMILESc1ccc(-n2c3ccccc3c3ccc4c5ccc([Si](c6ccccc6)(c6ccccc6)c6cccc(-c7ccccn7)c6)cc5n(-c5ccccn5)c4c32)cc1
InChIInChI=1S/C52H36N4Si/c1-4-18-38(19-5-1)55-48-27-11-10-25-43(48)45-31-32-46-44-30-29-42(36-49(44)56(52(46)51(45)55)50-28-13-15-34-54-50)57(39-20-6-2-7-21-39,40-22-8-3-9-23-40)41-24-16-17-37(35-41)47-26-12-14-33-53-47/h1-36H
InChIKeyXSJGPQLDPYLXPM-UHFFFAOYSA-N
MW744.97 g/mol
LogP9.72
Rot. Bonds7

About diphenyl-(11-phenyl-12-pyridin-2-ylindolo[2,3-a]carbazol-2-yl)-(3-pyridin-2-ylphenyl)silane

diphenyl-(11-phenyl-12-pyridin-2-ylindolo[2,3-a]carbazol-2-yl)-(3-pyridin-2-ylphenyl)silane (PubChem CID 140951427) has the molecular formula C52H36N4Si and a molecular weight of 744.97 g/mol. Its IUPAC name is diphenyl-(11-phenyl-12-pyridin-2-ylindolo[2,3-a]carbazol-2-yl)-(3-pyridin-2-ylphenyl)silane.

Molecular Properties

Compound Namediphenyl-(11-phenyl-12-pyridin-2-ylindolo[2,3-a]carbazol-2-yl)-(3-pyridin-2-ylphenyl)silane
PubChem CID140951427
Molecular FormulaC52H36N4Si
Molecular Weight744.97 g/mol
Exact Mass744.27
IUPAC Namediphenyl-(11-phenyl-12-pyridin-2-ylindolo[2,3-a]carbazol-2-yl)-(3-pyridin-2-ylphenyl)silane
SMILESc1ccc(-n2c3ccccc3c3ccc4c5ccc([Si](c6ccccc6)(c6ccccc6)c6cccc(-c7ccccn7)c6)cc5n(-c5ccccn5)c4c32)cc1
InChIInChI=1S/C52H36N4Si/c1-4-18-38(19-5-1)55-48-27-11-10-25-43(48)45-31-32-46-44-30-29-42(36-49(44)56(52(46)51(45)55)50-28-13-15-34-54-50)57(39-20-6-2-7-21-39,40-22-8-3-9-23-40)41-24-16-17-37(35-41)47-26-12-14-33-53-47/h1-36H
InChIKeyXSJGPQLDPYLXPM-UHFFFAOYSA-N
XLogP9.72
TPSA35.64 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms57
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500744.97
LogP ≤ 59.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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

diphenyl-(3-pyridin-2-ylphenyl)-(5,5,12-triphenyl-13-pyridin-2-yl-[1,4]benzazasilino[2,3-a]carbazol-2-yl)silane
CID 140952597
triphenyl-[9-(9-phenylcarbazol-1-yl)carbazol-2-yl]silane
CID 170515043
24-phenyl-3-pyridin-2-yl-3,24-diazahexacyclo[11.11.0.02,10.04,9.014,23.016,21]tetracosa-1(13),2(10),4,6,8,11,14,16,18,20,22-undecaene
CID 122465004
[3-(3,5-dimethylpyrazol-1-yl)phenyl]-diphenyl-(9-pyridin-2-ylcarbazol-2-yl)silane
CID 155636088
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
diphenyl-bis[4-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]silane
CID 88576991
3-[fluoro-(3-pyridin-2-ylphenyl)methyl]-11-phenyl-5-pyridin-2-ylindolo[3,2-b]carbazole
CID 140952126
(21,21-dimethyl-10-pyridin-2-yl-14-thia-10-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4(9),5,7,11,15,17,19-nonaen-7-yl)-diphenyl-(3-pyridin-2-ylphenyl)silane
CID 140954556
diphenyl-(9-phenylcarbazol-2-yl)-pyridin-2-ylsilane
CID 161189734
triphenyl-[7-phenyl-9-[9-(4-phenylphenyl)carbazol-1-yl]carbazol-2-yl]silane
CID 170515983
[4-(3-carbazol-9-ylcarbazol-9-yl)phenyl]-diphenyl-(4-pyridin-2-ylphenyl)silane
CID 132545707

Frequently Asked Questions

What is the IUPAC name of diphenyl-(11-phenyl-12-pyridin-2-ylindolo[2,3-a]carbazol-2-yl)-(3-pyridin-2-ylphenyl)silane?
The IUPAC name of diphenyl-(11-phenyl-12-pyridin-2-ylindolo[2,3-a]carbazol-2-yl)-(3-pyridin-2-ylphenyl)silane (CID 140951427) is diphenyl-(11-phenyl-12-pyridin-2-ylindolo[2,3-a]carbazol-2-yl)-(3-pyridin-2-ylphenyl)silane.
What is the SMILES notation for diphenyl-(11-phenyl-12-pyridin-2-ylindolo[2,3-a]carbazol-2-yl)-(3-pyridin-2-ylphenyl)silane?
The canonical SMILES for diphenyl-(11-phenyl-12-pyridin-2-ylindolo[2,3-a]carbazol-2-yl)-(3-pyridin-2-ylphenyl)silane is c1ccc(-n2c3ccccc3c3ccc4c5ccc([Si](c6ccccc6)(c6ccccc6)c6cccc(-c7ccccn7)c6)cc5n(-c5ccccn5)c4c32)cc1.
What is the InChIKey of diphenyl-(11-phenyl-12-pyridin-2-ylindolo[2,3-a]carbazol-2-yl)-(3-pyridin-2-ylphenyl)silane?
The InChIKey is XSJGPQLDPYLXPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C52H36N4Si/c1-4-18-38(19-5-1)55-48-27-11-10-25-43(48)45-31-32-46-44-30-29-42(36-49(44)56(52(46)51(45)55)50-28-13-15-34-54-50)57(39-20-6-2-7-21-39,40-22-8-3-9-23-40)41-24-16-17-37(35-41)47-26-12-14-33-53-47/h1-36H.
What are the key properties of diphenyl-(11-phenyl-12-pyridin-2-ylindolo[2,3-a]carbazol-2-yl)-(3-pyridin-2-ylphenyl)silane?
diphenyl-(11-phenyl-12-pyridin-2-ylindolo[2,3-a]carbazol-2-yl)-(3-pyridin-2-ylphenyl)silane has a molecular weight of 744.97 g/mol, XLogP of 9.72, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for diphenyl-(11-phenyl-12-pyridin-2-ylindolo[2,3-a]carbazol-2-yl)-(3-pyridin-2-ylphenyl)silane is sourced from PubChem (CID 140951427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).