4-[5-(4-fluorophenyl)-3-methyl-2-(4-methylsulfinylphenyl)imidazol-4-yl]pyridine

C22H18FN3OS — CID 10172850

IUPAC4-[5-(4-fluorophenyl)-3-methyl-2-(4-methylsulfinylphenyl)imidazol-4-yl]pyridine
SMILESCn1c(-c2ccc(S(C)=O)cc2)nc(-c2ccc(F)cc2)c1-c1ccncc1
InChIInChI=1S/C22H18FN3OS/c1-26-21(16-11-13-24-14-12-16)20(15-3-7-18(23)8-4-15)25-22(26)17-5-9-19(10-6-17)28(2)27/h3-14H,1-2H3
InChIKeyLFPRICXNGTVKHB-UHFFFAOYSA-N
MW391.47 g/mol
LogP4.69
Rot. Bonds4

About 4-[5-(4-fluorophenyl)-3-methyl-2-(4-methylsulfinylphenyl)imidazol-4-yl]pyridine

4-[5-(4-fluorophenyl)-3-methyl-2-(4-methylsulfinylphenyl)imidazol-4-yl]pyridine (PubChem CID 10172850) has the molecular formula C22H18FN3OS and a molecular weight of 391.47 g/mol. Its IUPAC name is 4-[5-(4-fluorophenyl)-3-methyl-2-(4-methylsulfinylphenyl)imidazol-4-yl]pyridine.

Molecular Properties

Compound Name4-[5-(4-fluorophenyl)-3-methyl-2-(4-methylsulfinylphenyl)imidazol-4-yl]pyridine
PubChem CID10172850
Molecular FormulaC22H18FN3OS
Molecular Weight391.47 g/mol
Exact Mass391.12
IUPAC Name4-[5-(4-fluorophenyl)-3-methyl-2-(4-methylsulfinylphenyl)imidazol-4-yl]pyridine
SMILESCn1c(-c2ccc(S(C)=O)cc2)nc(-c2ccc(F)cc2)c1-c1ccncc1
InChIInChI=1S/C22H18FN3OS/c1-26-21(16-11-13-24-14-12-16)20(15-3-7-18(23)8-4-15)25-22(26)17-5-9-19(10-6-17)28(2)27/h3-14H,1-2H3
InChIKeyLFPRICXNGTVKHB-UHFFFAOYSA-N
XLogP4.69
TPSA47.78 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.47
LogP ≤ 54.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 4-[5-(4-fluorophenyl)-3-methyl-2-(4-methylsulfinylphenyl)imidazol-4-yl]pyridine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-[5-(4-fluorophenyl)-3-methyl-2-(4-methylsulfinylphenyl)imidazol-4-yl]pyridine?
The IUPAC name of 4-[5-(4-fluorophenyl)-3-methyl-2-(4-methylsulfinylphenyl)imidazol-4-yl]pyridine (CID 10172850) is 4-[5-(4-fluorophenyl)-3-methyl-2-(4-methylsulfinylphenyl)imidazol-4-yl]pyridine.
What is the SMILES notation for 4-[5-(4-fluorophenyl)-3-methyl-2-(4-methylsulfinylphenyl)imidazol-4-yl]pyridine?
The canonical SMILES for 4-[5-(4-fluorophenyl)-3-methyl-2-(4-methylsulfinylphenyl)imidazol-4-yl]pyridine is Cn1c(-c2ccc(S(C)=O)cc2)nc(-c2ccc(F)cc2)c1-c1ccncc1.
What is the InChIKey of 4-[5-(4-fluorophenyl)-3-methyl-2-(4-methylsulfinylphenyl)imidazol-4-yl]pyridine?
The InChIKey is LFPRICXNGTVKHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18FN3OS/c1-26-21(16-11-13-24-14-12-16)20(15-3-7-18(23)8-4-15)25-22(26)17-5-9-19(10-6-17)28(2)27/h3-14H,1-2H3.
What are the key properties of 4-[5-(4-fluorophenyl)-3-methyl-2-(4-methylsulfinylphenyl)imidazol-4-yl]pyridine?
4-[5-(4-fluorophenyl)-3-methyl-2-(4-methylsulfinylphenyl)imidazol-4-yl]pyridine has a molecular weight of 391.47 g/mol, XLogP of 4.69, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-(4-fluorophenyl)-3-methyl-2-(4-methylsulfinylphenyl)imidazol-4-yl]pyridine is sourced from PubChem (CID 10172850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).