dibenzofuran-1-yl-diphenyl-(9-phenylcarbazol-3-yl)silane

C42H29NOSi — CID 170779740

IUPACdibenzofuran-1-yl-diphenyl-(9-phenylcarbazol-3-yl)silane
SMILESc1ccc(-n2c3ccccc3c3cc([Si](c4ccccc4)(c4ccccc4)c4cccc5oc6ccccc6c45)ccc32)cc1
InChIInChI=1S/C42H29NOSi/c1-4-15-30(16-5-1)43-37-23-12-10-21-34(37)36-29-33(27-28-38(36)43)45(31-17-6-2-7-18-31,32-19-8-3-9-20-32)41-26-14-25-40-42(41)35-22-11-13-24-39(35)44-40/h1-29H
InChIKeyZYNIRCRMKHNQND-UHFFFAOYSA-N
MW591.79 g/mol
LogP8.06
Rot. Bonds5

About dibenzofuran-1-yl-diphenyl-(9-phenylcarbazol-3-yl)silane

dibenzofuran-1-yl-diphenyl-(9-phenylcarbazol-3-yl)silane (PubChem CID 170779740) has the molecular formula C42H29NOSi and a molecular weight of 591.79 g/mol. Its IUPAC name is dibenzofuran-1-yl-diphenyl-(9-phenylcarbazol-3-yl)silane.

Molecular Properties

Compound Namedibenzofuran-1-yl-diphenyl-(9-phenylcarbazol-3-yl)silane
PubChem CID170779740
Molecular FormulaC42H29NOSi
Molecular Weight591.79 g/mol
Exact Mass591.20
IUPAC Namedibenzofuran-1-yl-diphenyl-(9-phenylcarbazol-3-yl)silane
SMILESc1ccc(-n2c3ccccc3c3cc([Si](c4ccccc4)(c4ccccc4)c4cccc5oc6ccccc6c45)ccc32)cc1
InChIInChI=1S/C42H29NOSi/c1-4-15-30(16-5-1)43-37-23-12-10-21-34(37)36-29-33(27-28-38(36)43)45(31-17-6-2-7-18-31,32-19-8-3-9-20-32)41-26-14-25-40-42(41)35-22-11-13-24-39(35)44-40/h1-29H
InChIKeyZYNIRCRMKHNQND-UHFFFAOYSA-N
XLogP8.06
TPSA18.07 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms45
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500591.79
LogP ≤ 58.06
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

[4-([1]benzofuro[3,2-b]carbazol-11-yl)phenyl]-diphenyl-(9-phenylcarbazol-3-yl)silane
CID 140842638
dibenzofuran-2-yl-diphenyl-[3-[3-(3-phenylcarbazol-9-yl)-5-triphenylsilylcarbazol-9-yl]phenyl]silane
CID 171457987
[3-(4-carbazol-9-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-dibenzofuran-1-yl-diphenylsilane
CID 164757108
dibenzothiophen-1-yl-diphenyl-(9-phenylcarbazol-3-yl)silane
CID 170779772
triphenyl-(12-phenyl-[1]benzofuro[3,2-a]carbazol-9-yl)silane
CID 58489529
dibenzofuran-4-yl-diphenyl-[3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]phenyl]silane
CID 89397692
[4-([1]benzofuro[3,2-c]carbazol-5-yl)phenyl]-diphenyl-(9-phenylcarbazol-3-yl)silane
CID 140842671
[3-[3-(4-dibenzofuran-1-ylcarbazol-9-yl)carbazol-9-yl]phenyl]-triphenylsilane
CID 166588993
diphenyl-(9-phenylcarbazol-3-yl)-[9-(9-phenylcarbazol-3-yl)carbazol-3-yl]silane
CID 89393751
9-[3-[[4-(9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)phenyl]-diphenylsilyl]phenyl]carbazole-3-carbonitrile
CID 140842581
dibenzofuran-2-yl-[3-[4-[4-[diphenyl-(4-phenylphenyl)silyl]carbazol-9-yl]carbazol-9-yl]phenyl]-diphenylsilane
CID 171457910
(3-carbazol-9-ylphenyl)-[3-(1-dibenzofuran-1-ylcarbazol-9-yl)phenyl]-diphenylsilane
CID 177073528

Frequently Asked Questions

What is the IUPAC name of dibenzofuran-1-yl-diphenyl-(9-phenylcarbazol-3-yl)silane?
The IUPAC name of dibenzofuran-1-yl-diphenyl-(9-phenylcarbazol-3-yl)silane (CID 170779740) is dibenzofuran-1-yl-diphenyl-(9-phenylcarbazol-3-yl)silane.
What is the SMILES notation for dibenzofuran-1-yl-diphenyl-(9-phenylcarbazol-3-yl)silane?
The canonical SMILES for dibenzofuran-1-yl-diphenyl-(9-phenylcarbazol-3-yl)silane is c1ccc(-n2c3ccccc3c3cc([Si](c4ccccc4)(c4ccccc4)c4cccc5oc6ccccc6c45)ccc32)cc1.
What is the InChIKey of dibenzofuran-1-yl-diphenyl-(9-phenylcarbazol-3-yl)silane?
The InChIKey is ZYNIRCRMKHNQND-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H29NOSi/c1-4-15-30(16-5-1)43-37-23-12-10-21-34(37)36-29-33(27-28-38(36)43)45(31-17-6-2-7-18-31,32-19-8-3-9-20-32)41-26-14-25-40-42(41)35-22-11-13-24-39(35)44-40/h1-29H.
What are the key properties of dibenzofuran-1-yl-diphenyl-(9-phenylcarbazol-3-yl)silane?
dibenzofuran-1-yl-diphenyl-(9-phenylcarbazol-3-yl)silane has a molecular weight of 591.79 g/mol, XLogP of 8.06, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dibenzofuran-1-yl-diphenyl-(9-phenylcarbazol-3-yl)silane is sourced from PubChem (CID 170779740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).