2-imidazol-1-ylethyl-bis(4-phenylphenyl)silane

C29H26N2Si — CID 173417558

IUPAC2-imidazol-1-ylethyl-bis(4-phenylphenyl)silane
SMILESc1ccc(-c2ccc([SiH](CCn3ccnc3)c3ccc(-c4ccccc4)cc3)cc2)cc1
InChIInChI=1S/C29H26N2Si/c1-3-7-24(8-4-1)26-11-15-28(16-12-26)32(22-21-31-20-19-30-23-31)29-17-13-27(14-18-29)25-9-5-2-6-10-25/h1-20,23,32H,21-22H2
InChIKeyUDTZWVHZOSTTCP-UHFFFAOYSA-N
MW430.63 g/mol
LogP5.26
Rot. Bonds7

About 2-imidazol-1-ylethyl-bis(4-phenylphenyl)silane

2-imidazol-1-ylethyl-bis(4-phenylphenyl)silane (PubChem CID 173417558) has the molecular formula C29H26N2Si and a molecular weight of 430.63 g/mol. Its IUPAC name is 2-imidazol-1-ylethyl-bis(4-phenylphenyl)silane.

Molecular Properties

Compound Name2-imidazol-1-ylethyl-bis(4-phenylphenyl)silane
PubChem CID173417558
Molecular FormulaC29H26N2Si
Molecular Weight430.63 g/mol
Exact Mass430.19
IUPAC Name2-imidazol-1-ylethyl-bis(4-phenylphenyl)silane
SMILESc1ccc(-c2ccc([SiH](CCn3ccnc3)c3ccc(-c4ccccc4)cc3)cc2)cc1
InChIInChI=1S/C29H26N2Si/c1-3-7-24(8-4-1)26-11-15-28(16-12-26)32(22-21-31-20-19-30-23-31)29-17-13-27(14-18-29)25-9-5-2-6-10-25/h1-20,23,32H,21-22H2
InChIKeyUDTZWVHZOSTTCP-UHFFFAOYSA-N
XLogP5.26
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500430.63
LogP ≤ 55.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

bis(4-fluorophenyl)-(2-imidazol-1-ylethyl)silane
CID 173417874
1-[(3-phenylpyrrol-1-yl)methyl]imidazole
CID 141118913
N-(3-imidazol-1-ylpropyl)-2-(4-phenylphenyl)propan-2-amine
CID 19429444
2-imidazol-1-yl-1-phenyl-1-(4-phenylphenyl)ethanol
CID 13013640
N-(3-imidazol-1-ylpropyl)-2-(4-phenylphenyl)acetamide
CID 35513194
1-[2-(2-fluorophenyl)-2-(4-phenylphenyl)ethyl]imidazole
CID 12831919
imidazol-1-ylmethyl-methoxy-methyl-(4-phenylphenyl)silane
CID 70477499
1-[4-(2-phenylphenoxy)butyl]imidazole
CID 4998739
benzoic acid;1-propylimidazole
CID 173073057
1-(8-phenyloctyl)imidazole
CID 102394184
1-(2-diphenylphosphorylethyl)imidazole
CID 19358917
4-(imidazol-1-ylmethyl)-2-phenylpyrimidine
CID 131736320

Frequently Asked Questions

What is the IUPAC name of 2-imidazol-1-ylethyl-bis(4-phenylphenyl)silane?
The IUPAC name of 2-imidazol-1-ylethyl-bis(4-phenylphenyl)silane (CID 173417558) is 2-imidazol-1-ylethyl-bis(4-phenylphenyl)silane.
What is the SMILES notation for 2-imidazol-1-ylethyl-bis(4-phenylphenyl)silane?
The canonical SMILES for 2-imidazol-1-ylethyl-bis(4-phenylphenyl)silane is c1ccc(-c2ccc([SiH](CCn3ccnc3)c3ccc(-c4ccccc4)cc3)cc2)cc1.
What is the InChIKey of 2-imidazol-1-ylethyl-bis(4-phenylphenyl)silane?
The InChIKey is UDTZWVHZOSTTCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H26N2Si/c1-3-7-24(8-4-1)26-11-15-28(16-12-26)32(22-21-31-20-19-30-23-31)29-17-13-27(14-18-29)25-9-5-2-6-10-25/h1-20,23,32H,21-22H2.
What are the key properties of 2-imidazol-1-ylethyl-bis(4-phenylphenyl)silane?
2-imidazol-1-ylethyl-bis(4-phenylphenyl)silane has a molecular weight of 430.63 g/mol, XLogP of 5.26, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-imidazol-1-ylethyl-bis(4-phenylphenyl)silane is sourced from PubChem (CID 173417558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).