5,5-diphenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]benzo[b][1]benzosilol-4-amine

C54H39NSi — CID 153426606

IUPAC5,5-diphenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]benzo[b][1]benzosilol-4-amine
SMILESc1ccc(-c2ccc(-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4cccc5c4[Si](c4ccccc4)(c4ccccc4)c4ccccc4-5)cc3)cc2)cc1
InChIInChI=1S/C54H39NSi/c1-5-16-40(17-6-1)42-28-30-43(31-29-42)45-34-38-47(39-35-45)55(46-36-32-44(33-37-46)41-18-7-2-8-19-41)52-26-15-25-51-50-24-13-14-27-53(50)56(54(51)52,48-20-9-3-10-21-48)49-22-11-4-12-23-49/h1-39H
InChIKeyRYKJONWZYJHUTN-UHFFFAOYSA-N
MW730.00 g/mol
LogP11.52
Rot. Bonds8

About 5,5-diphenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]benzo[b][1]benzosilol-4-amine

5,5-diphenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]benzo[b][1]benzosilol-4-amine (PubChem CID 153426606) has the molecular formula C54H39NSi and a molecular weight of 730.00 g/mol. Its IUPAC name is 5,5-diphenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]benzo[b][1]benzosilol-4-amine.

Molecular Properties

Compound Name5,5-diphenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]benzo[b][1]benzosilol-4-amine
PubChem CID153426606
Molecular FormulaC54H39NSi
Molecular Weight730.00 g/mol
Exact Mass729.29
IUPAC Name5,5-diphenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]benzo[b][1]benzosilol-4-amine
SMILESc1ccc(-c2ccc(-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4cccc5c4[Si](c4ccccc4)(c4ccccc4)c4ccccc4-5)cc3)cc2)cc1
InChIInChI=1S/C54H39NSi/c1-5-16-40(17-6-1)42-28-30-43(31-29-42)45-34-38-47(39-35-45)55(46-36-32-44(33-37-46)41-18-7-2-8-19-41)52-26-15-25-51-50-24-13-14-27-53(50)56(54(51)52,48-20-9-3-10-21-48)49-22-11-4-12-23-49/h1-39H
InChIKeyRYKJONWZYJHUTN-UHFFFAOYSA-N
XLogP11.52
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms56
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500730.00
LogP ≤ 511.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze 5,5-diphenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]benzo[b][1]benzosilol-4-amine with MolForge

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Related Compounds

N-[4-(5-phenylbenzo[b][1]benzosilol-5-yl)phenyl]-N-(4-phenylphenyl)naphthalen-1-amine
CID 153282049
N,11,11-triphenyl-N-[4-(8-phenylnaphthalen-1-yl)phenyl]naphtho[1,2-b][1]benzosilol-1-amine
CID 169285487
N,N-bis(4-phenylphenyl)spiro[benzo[b][1,4]benzoxasiline-10,5'-benzo[b][1]benzosilole]-4-amine
CID 146793729
N,7,7-triphenyl-N-[4-(8-phenylnaphthalen-1-yl)phenyl]naphtho[2,1-b][1]benzosilol-8-amine
CID 169285216
N-(2,4-diphenylphenyl)-5,5-diphenyl-N-[4-(4-phenylphenyl)phenyl]benzo[b][1]benzosilol-1-amine
CID 142346953
N,N-diphenyl-4-(5-phenylbenzo[b][1]benzosilol-5-yl)aniline
CID 153426650
N,11,11-triphenyl-N-[4-(8-phenylnaphthalen-1-yl)phenyl]naphtho[1,2-b][1]benzosilol-6-amine
CID 169285601
N-[4-(5,5-diphenylbenzo[b][1]benzosilol-2-yl)phenyl]-N-(4-phenylphenyl)phenanthren-9-amine
CID 140728891
5,5-dinaphthalen-2-yl-N,N-bis(4-phenylphenyl)benzo[b][1]benzosilol-1-amine
CID 153426671
N,N-diphenyl-4-[5-[4-(N-phenylanilino)phenyl]benzo[b][1]benzosilol-5-yl]aniline
CID 165050185
N-(4-naphthalen-1-ylphenyl)-5-(10-phenylbenzo[b][1,4]benzoxasilin-10-yl)-N-(4-phenylphenyl)naphthalen-1-amine
CID 140872051
N,N-bis(4-phenylphenyl)-2-[2-[2-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]aniline
CID 163940661

Frequently Asked Questions

What is the IUPAC name of 5,5-diphenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]benzo[b][1]benzosilol-4-amine?
The IUPAC name of 5,5-diphenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]benzo[b][1]benzosilol-4-amine (CID 153426606) is 5,5-diphenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]benzo[b][1]benzosilol-4-amine.
What is the SMILES notation for 5,5-diphenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]benzo[b][1]benzosilol-4-amine?
The canonical SMILES for 5,5-diphenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]benzo[b][1]benzosilol-4-amine is c1ccc(-c2ccc(-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4cccc5c4[Si](c4ccccc4)(c4ccccc4)c4ccccc4-5)cc3)cc2)cc1.
What is the InChIKey of 5,5-diphenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]benzo[b][1]benzosilol-4-amine?
The InChIKey is RYKJONWZYJHUTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H39NSi/c1-5-16-40(17-6-1)42-28-30-43(31-29-42)45-34-38-47(39-35-45)55(46-36-32-44(33-37-46)41-18-7-2-8-19-41)52-26-15-25-51-50-24-13-14-27-53(50)56(54(51)52,48-20-9-3-10-21-48)49-22-11-4-12-23-49/h1-39H.
What are the key properties of 5,5-diphenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]benzo[b][1]benzosilol-4-amine?
5,5-diphenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]benzo[b][1]benzosilol-4-amine has a molecular weight of 730.00 g/mol, XLogP of 11.52, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-diphenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]benzo[b][1]benzosilol-4-amine is sourced from PubChem (CID 153426606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).