4-(4-phenylphenyl)-1-(2-trimethylsilylethoxymethyl)imidazole-2-carbaldehyde

C22H26N2O2Si — CID 141048810

IUPAC4-(4-phenylphenyl)-1-(2-trimethylsilylethoxymethyl)imidazole-2-carbaldehyde
SMILESC[Si](C)(C)CCOCn1cc(-c2ccc(-c3ccccc3)cc2)nc1C=O
InChIInChI=1S/C22H26N2O2Si/c1-27(2,3)14-13-26-17-24-15-21(23-22(24)16-25)20-11-9-19(10-12-20)18-7-5-4-6-8-18/h4-12,15-16H,13-14,17H2,1-3H3
InChIKeyZQNWEFWYJDGANS-UHFFFAOYSA-N
MW378.55 g/mol
LogP5.34
Rot. Bonds8

About 4-(4-phenylphenyl)-1-(2-trimethylsilylethoxymethyl)imidazole-2-carbaldehyde

4-(4-phenylphenyl)-1-(2-trimethylsilylethoxymethyl)imidazole-2-carbaldehyde (PubChem CID 141048810) has the molecular formula C22H26N2O2Si and a molecular weight of 378.55 g/mol. Its IUPAC name is 4-(4-phenylphenyl)-1-(2-trimethylsilylethoxymethyl)imidazole-2-carbaldehyde.

Molecular Properties

Compound Name4-(4-phenylphenyl)-1-(2-trimethylsilylethoxymethyl)imidazole-2-carbaldehyde
PubChem CID141048810
Molecular FormulaC22H26N2O2Si
Molecular Weight378.55 g/mol
Exact Mass378.18
IUPAC Name4-(4-phenylphenyl)-1-(2-trimethylsilylethoxymethyl)imidazole-2-carbaldehyde
SMILESC[Si](C)(C)CCOCn1cc(-c2ccc(-c3ccccc3)cc2)nc1C=O
InChIInChI=1S/C22H26N2O2Si/c1-27(2,3)14-13-26-17-24-15-21(23-22(24)16-25)20-11-9-19(10-12-20)18-7-5-4-6-8-18/h4-12,15-16H,13-14,17H2,1-3H3
InChIKeyZQNWEFWYJDGANS-UHFFFAOYSA-N
XLogP5.34
TPSA44.12 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500378.55
LogP ≤ 55.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 4-(4-phenylphenyl)-1-(2-trimethylsilylethoxymethyl)imidazole-2-carbaldehyde with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-bromo-1-(2-trimethylsilylethoxymethyl)imidazole-2-carbaldehyde
CID 87132869
4-(trifluoromethyl)-1-(2-trimethylsilylethoxymethyl)imidazole-2-carbaldehyde
CID 22018765
4-methyl-5-phenyl-1-(2-trimethylsilylethoxymethyl)imidazole-2-carbaldehyde
CID 22018699
methyl 2-formyl-1-(2-trimethylsilylethoxymethyl)imidazole-4-carboxylate
CID 58638526
1-(2-hydroxy-2-methylpropyl)-4-phenylimidazole-2-carbaldehyde
CID 87085677
trimethyl-[2-[(3-phenyl-5-trimethylstannyl-1,2,4-triazol-1-yl)methoxy]ethyl]silane
CID 168730347
1-(2-trimethylsilylethoxymethyl)pyrrole-3-carbaldehyde
CID 91103274
trimethyl-[2-[(6-phenylindazol-1-yl)methoxy]ethyl]silane
CID 141183525
1-ethyl-4-(4-phenylphenyl)-2-[(E)-2-(4-phenylphenyl)ethenyl]imidazole
CID 141094204
trimethyl-[2-[(3-phenylpyrrolo[3,2-b]pyridin-1-yl)methoxy]ethyl]silane
CID 170762612
1-(2-hydroxy-2-methylpropyl)-4-phenylimidazole-2-carbaldehyde;1-[(2S)-2-hydroxypropyl]-4-phenylimidazole-2-carbaldehyde;1-[(2R)-2-hydroxypropyl]-4-phenylimidazole-2-carbaldehyde
CID 159037791
2-[(2-bromo-5-phenylpyrrol-1-yl)methoxy]ethyl-trimethylsilane
CID 141389098

Frequently Asked Questions

What is the IUPAC name of 4-(4-phenylphenyl)-1-(2-trimethylsilylethoxymethyl)imidazole-2-carbaldehyde?
The IUPAC name of 4-(4-phenylphenyl)-1-(2-trimethylsilylethoxymethyl)imidazole-2-carbaldehyde (CID 141048810) is 4-(4-phenylphenyl)-1-(2-trimethylsilylethoxymethyl)imidazole-2-carbaldehyde.
What is the SMILES notation for 4-(4-phenylphenyl)-1-(2-trimethylsilylethoxymethyl)imidazole-2-carbaldehyde?
The canonical SMILES for 4-(4-phenylphenyl)-1-(2-trimethylsilylethoxymethyl)imidazole-2-carbaldehyde is C[Si](C)(C)CCOCn1cc(-c2ccc(-c3ccccc3)cc2)nc1C=O.
What is the InChIKey of 4-(4-phenylphenyl)-1-(2-trimethylsilylethoxymethyl)imidazole-2-carbaldehyde?
The InChIKey is ZQNWEFWYJDGANS-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N2O2Si/c1-27(2,3)14-13-26-17-24-15-21(23-22(24)16-25)20-11-9-19(10-12-20)18-7-5-4-6-8-18/h4-12,15-16H,13-14,17H2,1-3H3.
What are the key properties of 4-(4-phenylphenyl)-1-(2-trimethylsilylethoxymethyl)imidazole-2-carbaldehyde?
4-(4-phenylphenyl)-1-(2-trimethylsilylethoxymethyl)imidazole-2-carbaldehyde has a molecular weight of 378.55 g/mol, XLogP of 5.34, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-phenylphenyl)-1-(2-trimethylsilylethoxymethyl)imidazole-2-carbaldehyde is sourced from PubChem (CID 141048810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).