2-(4-chlorophenyl)-4-(difluoromethyl)-1-(4-methylsulfonylphenyl)imidazole

C17H13ClF2N2O2S — CID 10762494

IUPAC2-(4-chlorophenyl)-4-(difluoromethyl)-1-(4-methylsulfonylphenyl)imidazole
SMILESCS(=O)(=O)c1ccc(-n2cc(C(F)F)nc2-c2ccc(Cl)cc2)cc1
InChIInChI=1S/C17H13ClF2N2O2S/c1-25(23,24)14-8-6-13(7-9-14)22-10-15(16(19)20)21-17(22)11-2-4-12(18)5-3-11/h2-10,16H,1H3
InChIKeyBPPAIAOYYMOYRE-UHFFFAOYSA-N
MW382.82 g/mol
LogP4.53
Rot. Bonds4

About 2-(4-chlorophenyl)-4-(difluoromethyl)-1-(4-methylsulfonylphenyl)imidazole

2-(4-chlorophenyl)-4-(difluoromethyl)-1-(4-methylsulfonylphenyl)imidazole (PubChem CID 10762494) has the molecular formula C17H13ClF2N2O2S and a molecular weight of 382.82 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-4-(difluoromethyl)-1-(4-methylsulfonylphenyl)imidazole.

Molecular Properties

Compound Name2-(4-chlorophenyl)-4-(difluoromethyl)-1-(4-methylsulfonylphenyl)imidazole
PubChem CID10762494
Molecular FormulaC17H13ClF2N2O2S
Molecular Weight382.82 g/mol
Exact Mass382.04
IUPAC Name2-(4-chlorophenyl)-4-(difluoromethyl)-1-(4-methylsulfonylphenyl)imidazole
SMILESCS(=O)(=O)c1ccc(-n2cc(C(F)F)nc2-c2ccc(Cl)cc2)cc1
InChIInChI=1S/C17H13ClF2N2O2S/c1-25(23,24)14-8-6-13(7-9-14)22-10-15(16(19)20)21-17(22)11-2-4-12(18)5-3-11/h2-10,16H,1H3
InChIKeyBPPAIAOYYMOYRE-UHFFFAOYSA-N
XLogP4.53
TPSA51.96 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.82
LogP ≤ 54.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-(4-chlorophenyl)-4-(difluoromethyl)-1-(4-methylsulfonylphenyl)imidazole 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 2-(4-chlorophenyl)-4-(difluoromethyl)-1-(4-methylsulfonylphenyl)imidazole?
The IUPAC name of 2-(4-chlorophenyl)-4-(difluoromethyl)-1-(4-methylsulfonylphenyl)imidazole (CID 10762494) is 2-(4-chlorophenyl)-4-(difluoromethyl)-1-(4-methylsulfonylphenyl)imidazole.
What is the SMILES notation for 2-(4-chlorophenyl)-4-(difluoromethyl)-1-(4-methylsulfonylphenyl)imidazole?
The canonical SMILES for 2-(4-chlorophenyl)-4-(difluoromethyl)-1-(4-methylsulfonylphenyl)imidazole is CS(=O)(=O)c1ccc(-n2cc(C(F)F)nc2-c2ccc(Cl)cc2)cc1.
What is the InChIKey of 2-(4-chlorophenyl)-4-(difluoromethyl)-1-(4-methylsulfonylphenyl)imidazole?
The InChIKey is BPPAIAOYYMOYRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13ClF2N2O2S/c1-25(23,24)14-8-6-13(7-9-14)22-10-15(16(19)20)21-17(22)11-2-4-12(18)5-3-11/h2-10,16H,1H3.
What are the key properties of 2-(4-chlorophenyl)-4-(difluoromethyl)-1-(4-methylsulfonylphenyl)imidazole?
2-(4-chlorophenyl)-4-(difluoromethyl)-1-(4-methylsulfonylphenyl)imidazole has a molecular weight of 382.82 g/mol, XLogP of 4.53, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-4-(difluoromethyl)-1-(4-methylsulfonylphenyl)imidazole is sourced from PubChem (CID 10762494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).