1-(4-chlorophenyl)sulfonyl-2,4-dimethylimidazole

C11H11ClN2O2S — CID 700899

IUPAC1-(4-chlorophenyl)sulfonyl-2,4-dimethylimidazole
SMILESCc1cn(S(=O)(=O)c2ccc(Cl)cc2)c(C)n1
InChIInChI=1S/C11H11ClN2O2S/c1-8-7-14(9(2)13-8)17(15,16)11-5-3-10(12)4-6-11/h3-7H,1-2H3
InChIKeyDGEPWGYIIWUKMT-UHFFFAOYSA-N
MW270.74 g/mol
LogP2.39
Rot. Bonds2

About 1-(4-chlorophenyl)sulfonyl-2,4-dimethylimidazole

1-(4-chlorophenyl)sulfonyl-2,4-dimethylimidazole (PubChem CID 700899) has the molecular formula C11H11ClN2O2S and a molecular weight of 270.74 g/mol. Its IUPAC name is 1-(4-chlorophenyl)sulfonyl-2,4-dimethylimidazole.

Molecular Properties

Compound Name1-(4-chlorophenyl)sulfonyl-2,4-dimethylimidazole
PubChem CID700899
Molecular FormulaC11H11ClN2O2S
Molecular Weight270.74 g/mol
Exact Mass270.02
IUPAC Name1-(4-chlorophenyl)sulfonyl-2,4-dimethylimidazole
SMILESCc1cn(S(=O)(=O)c2ccc(Cl)cc2)c(C)n1
InChIInChI=1S/C11H11ClN2O2S/c1-8-7-14(9(2)13-8)17(15,16)11-5-3-10(12)4-6-11/h3-7H,1-2H3
InChIKeyDGEPWGYIIWUKMT-UHFFFAOYSA-N
XLogP2.39
TPSA51.96 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.74
LogP ≤ 52.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4-Bromo-benzenesulfonyl)-2-ethyl-4-methyl-1H-imidazole
CID 775784
[(4-Chlorophenyl)sulfonyl](2-imidazol-4-ylethyl)amine
CID 4204841
4-Chloro-N-[4-(1H-imidazol-4-yl)-butyl]-N-methyl-benzenesulfonamide
CID 10404201
1-(4-chlorophenyl)sulfonyl-3-[2-(1H-imidazol-5-yl)ethyl]urea
CID 44304488
3-Chloro-N-[4-(1H-imidazol-4-yl)-butyl]-benzenesulfonamide
CID 44308789
4-Chloro-N-[5-(1H-imidazol-4-yl)-pentyl]-benzenesulfonamide
CID 44308790
4-Chloro-N-[4-(1H-imidazol-4-yl)-butyl]-benzenesulfonamide
CID 44308838
4-Chloro-N-[3-(1H-imidazol-4-yl)-propyl]-benzenesulfonamide
CID 44308915
1-(4-Chlorophenyl)sulfonyl-2-methyl-4-nitroimidazole
CID 42644676
4-chloro-N-[1-(1,5-dimethyl-1H-imidazol-2-yl)-2-phenylethyl]benzenesulfonamide
CID 17747461
1-(2,4-Dichlorophenyl)sulfonylimidazole
CID 4914608
1-(3-Chloro-4-fluorophenyl)sulfonyl-4-methylimidazole
CID 16010024

Frequently Asked Questions

What is the IUPAC name of 1-(4-chlorophenyl)sulfonyl-2,4-dimethylimidazole?
The IUPAC name of 1-(4-chlorophenyl)sulfonyl-2,4-dimethylimidazole (CID 700899) is 1-(4-chlorophenyl)sulfonyl-2,4-dimethylimidazole.
What is the SMILES notation for 1-(4-chlorophenyl)sulfonyl-2,4-dimethylimidazole?
The canonical SMILES for 1-(4-chlorophenyl)sulfonyl-2,4-dimethylimidazole is Cc1cn(S(=O)(=O)c2ccc(Cl)cc2)c(C)n1.
What is the InChIKey of 1-(4-chlorophenyl)sulfonyl-2,4-dimethylimidazole?
The InChIKey is DGEPWGYIIWUKMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11ClN2O2S/c1-8-7-14(9(2)13-8)17(15,16)11-5-3-10(12)4-6-11/h3-7H,1-2H3.
What are the key properties of 1-(4-chlorophenyl)sulfonyl-2,4-dimethylimidazole?
1-(4-chlorophenyl)sulfonyl-2,4-dimethylimidazole has a molecular weight of 270.74 g/mol, XLogP of 2.39, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chlorophenyl)sulfonyl-2,4-dimethylimidazole is sourced from PubChem (CID 700899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).