1-[(2,4-dichlorophenyl)methyl]-2-methylimidazole-4-sulfonamide

C11H11Cl2N3O2S — CID 81340078

IUPAC1-[(2,4-dichlorophenyl)methyl]-2-methylimidazole-4-sulfonamide
SMILESCc1nc(S(N)(=O)=O)cn1Cc1ccc(Cl)cc1Cl
InChIInChI=1S/C11H11Cl2N3O2S/c1-7-15-11(19(14,17)18)6-16(7)5-8-2-3-9(12)4-10(8)13/h2-4,6H,5H2,1H3,(H2,14,17,18)
InChIKeyUGWQLVGKGDIZNP-UHFFFAOYSA-N
MW320.20 g/mol
LogP2.19
Rot. Bonds3

About 1-[(2,4-dichlorophenyl)methyl]-2-methylimidazole-4-sulfonamide

1-[(2,4-dichlorophenyl)methyl]-2-methylimidazole-4-sulfonamide (PubChem CID 81340078) has the molecular formula C11H11Cl2N3O2S and a molecular weight of 320.20 g/mol. Its IUPAC name is 1-[(2,4-dichlorophenyl)methyl]-2-methylimidazole-4-sulfonamide.

Molecular Properties

Compound Name1-[(2,4-dichlorophenyl)methyl]-2-methylimidazole-4-sulfonamide
PubChem CID81340078
Molecular FormulaC11H11Cl2N3O2S
Molecular Weight320.20 g/mol
Exact Mass318.99
IUPAC Name1-[(2,4-dichlorophenyl)methyl]-2-methylimidazole-4-sulfonamide
SMILESCc1nc(S(N)(=O)=O)cn1Cc1ccc(Cl)cc1Cl
InChIInChI=1S/C11H11Cl2N3O2S/c1-7-15-11(19(14,17)18)6-16(7)5-8-2-3-9(12)4-10(8)13/h2-4,6H,5H2,1H3,(H2,14,17,18)
InChIKeyUGWQLVGKGDIZNP-UHFFFAOYSA-N
XLogP2.19
TPSA77.98 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.20
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-[(2,4-dichlorophenyl)methyl]-2-methylimidazole-4-sulfonamide 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

1-[(5-chloro-2-fluorophenyl)methyl]-2-methylimidazole-4-sulfonamide
CID 103051987
1-[(4-chloro-2-fluorophenyl)methyl]-2-methylimidazole-4-sulfonyl chloride
CID 114857558
1-[(2-chloro-4-methylphenyl)methyl]-2-propan-2-ylimidazole-4-sulfonamide
CID 106871058
N-(5-chlorothiophen-2-yl)sulfonyl-1-[(2,4-dichlorophenyl)methyl]-2-methylimidazole-4-carboxamide
CID 57171958
(E)-3-[1-[(2,4-dichlorophenyl)methyl]-2-methylimidazol-4-yl]-N-pentylsulfonylprop-2-enamide
CID 21198572
N-[4-bromo-1-[(2,4-dichlorophenyl)methyl]pyrazol-3-yl]ethanesulfonamide
CID 22206646
N-(2-amino-4-chlorophenyl)-1-ethyl-2-methylimidazole-4-sulfonamide
CID 62062819
N-(2-bromo-4-chlorophenyl)-1-ethyl-2-methylimidazole-4-sulfonamide
CID 81273250
1-[(3,4-dichlorophenyl)methyl]-2-propan-2-ylimidazole-4-sulfonamide
CID 81337314
1-(2-cyclopropylethyl)-2-methylimidazole-4-sulfonamide
CID 81340861
4-[(2,4-dichlorophenyl)methyl]-3-methyl-1H-1,2,4-triazol-5-one
CID 50982347
1-[(2-amino-4-chlorophenyl)methyl]-5-methylpyrimidin-2-one
CID 63206023

Frequently Asked Questions

What is the IUPAC name of 1-[(2,4-dichlorophenyl)methyl]-2-methylimidazole-4-sulfonamide?
The IUPAC name of 1-[(2,4-dichlorophenyl)methyl]-2-methylimidazole-4-sulfonamide (CID 81340078) is 1-[(2,4-dichlorophenyl)methyl]-2-methylimidazole-4-sulfonamide.
What is the SMILES notation for 1-[(2,4-dichlorophenyl)methyl]-2-methylimidazole-4-sulfonamide?
The canonical SMILES for 1-[(2,4-dichlorophenyl)methyl]-2-methylimidazole-4-sulfonamide is Cc1nc(S(N)(=O)=O)cn1Cc1ccc(Cl)cc1Cl.
What is the InChIKey of 1-[(2,4-dichlorophenyl)methyl]-2-methylimidazole-4-sulfonamide?
The InChIKey is UGWQLVGKGDIZNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11Cl2N3O2S/c1-7-15-11(19(14,17)18)6-16(7)5-8-2-3-9(12)4-10(8)13/h2-4,6H,5H2,1H3,(H2,14,17,18).
What are the key properties of 1-[(2,4-dichlorophenyl)methyl]-2-methylimidazole-4-sulfonamide?
1-[(2,4-dichlorophenyl)methyl]-2-methylimidazole-4-sulfonamide has a molecular weight of 320.20 g/mol, XLogP of 2.19, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2,4-dichlorophenyl)methyl]-2-methylimidazole-4-sulfonamide is sourced from PubChem (CID 81340078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).