5-chloro-N-[2-(4-ethoxyphenoxy)phenyl]-1-methylimidazole-4-sulfonamide

C18H18ClN3O4S — CID 55590040

IUPAC5-chloro-N-[2-(4-ethoxyphenoxy)phenyl]-1-methylimidazole-4-sulfonamide
SMILESCCOc1ccc(Oc2ccccc2NS(=O)(=O)c2ncn(C)c2Cl)cc1
InChIInChI=1S/C18H18ClN3O4S/c1-3-25-13-8-10-14(11-9-13)26-16-7-5-4-6-15(16)21-27(23,24)18-17(19)22(2)12-20-18/h4-12,21H,3H2,1-2H3
InChIKeyHKNXKJUQTAKTBD-UHFFFAOYSA-N
MW407.88 g/mol
LogP4.07
Rot. Bonds7

About 5-chloro-N-[2-(4-ethoxyphenoxy)phenyl]-1-methylimidazole-4-sulfonamide

5-chloro-N-[2-(4-ethoxyphenoxy)phenyl]-1-methylimidazole-4-sulfonamide (PubChem CID 55590040) has the molecular formula C18H18ClN3O4S and a molecular weight of 407.88 g/mol. Its IUPAC name is 5-chloro-N-[2-(4-ethoxyphenoxy)phenyl]-1-methylimidazole-4-sulfonamide.

Molecular Properties

Compound Name5-chloro-N-[2-(4-ethoxyphenoxy)phenyl]-1-methylimidazole-4-sulfonamide
PubChem CID55590040
Molecular FormulaC18H18ClN3O4S
Molecular Weight407.88 g/mol
Exact Mass407.07
IUPAC Name5-chloro-N-[2-(4-ethoxyphenoxy)phenyl]-1-methylimidazole-4-sulfonamide
SMILESCCOc1ccc(Oc2ccccc2NS(=O)(=O)c2ncn(C)c2Cl)cc1
InChIInChI=1S/C18H18ClN3O4S/c1-3-25-13-8-10-14(11-9-13)26-16-7-5-4-6-15(16)21-27(23,24)18-17(19)22(2)12-20-18/h4-12,21H,3H2,1-2H3
InChIKeyHKNXKJUQTAKTBD-UHFFFAOYSA-N
XLogP4.07
TPSA82.45 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500407.88
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 5-chloro-N-[2-(4-ethoxyphenoxy)phenyl]-1-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

N-[2-(4-ethoxyphenoxy)phenyl]-1,3,5-trimethylpyrazole-4-sulfonamide
CID 8823361
5-chloro-1-methyl-N-(4-phenoxyphenyl)imidazole-4-sulfonamide
CID 46594182
5-chloro-N-(2,4-dimethoxyphenyl)-1-methylimidazole-4-sulfonamide
CID 43415198
5-chloro-N-(2-fluorophenyl)-1-methylimidazole-4-sulfonamide
CID 43415160
N-[2-(4-ethoxyphenoxy)phenyl]-4-propan-2-ylbenzenesulfonamide
CID 7938368
5-chloro-N-(2,3-dichlorophenyl)-1-methylimidazole-4-sulfonamide
CID 43456018
5-chloro-1-methyl-N-(2-nitrophenyl)imidazole-4-sulfonamide
CID 61051631
4-ethoxy-N-(2-ethoxyphenyl)benzenesulfonamide
CID 7559506
N-[2-(4-ethoxyphenoxy)phenyl]-3-methyl-2-oxo-1,3-benzoxazole-6-sulfonamide
CID 30713533
N-[2-(4-ethoxyphenoxy)phenyl]-1-methyl-2-oxo-3H-indole-5-sulfonamide
CID 17460804
5-chloro-1-methyl-N-naphthalen-2-ylimidazole-4-sulfonamide
CID 60747502
N-[5-[[2-(4-ethoxyphenoxy)phenyl]sulfamoyl]-2-methoxyphenyl]acetamide
CID 17426332

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[2-(4-ethoxyphenoxy)phenyl]-1-methylimidazole-4-sulfonamide?
The IUPAC name of 5-chloro-N-[2-(4-ethoxyphenoxy)phenyl]-1-methylimidazole-4-sulfonamide (CID 55590040) is 5-chloro-N-[2-(4-ethoxyphenoxy)phenyl]-1-methylimidazole-4-sulfonamide.
What is the SMILES notation for 5-chloro-N-[2-(4-ethoxyphenoxy)phenyl]-1-methylimidazole-4-sulfonamide?
The canonical SMILES for 5-chloro-N-[2-(4-ethoxyphenoxy)phenyl]-1-methylimidazole-4-sulfonamide is CCOc1ccc(Oc2ccccc2NS(=O)(=O)c2ncn(C)c2Cl)cc1.
What is the InChIKey of 5-chloro-N-[2-(4-ethoxyphenoxy)phenyl]-1-methylimidazole-4-sulfonamide?
The InChIKey is HKNXKJUQTAKTBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18ClN3O4S/c1-3-25-13-8-10-14(11-9-13)26-16-7-5-4-6-15(16)21-27(23,24)18-17(19)22(2)12-20-18/h4-12,21H,3H2,1-2H3.
What are the key properties of 5-chloro-N-[2-(4-ethoxyphenoxy)phenyl]-1-methylimidazole-4-sulfonamide?
5-chloro-N-[2-(4-ethoxyphenoxy)phenyl]-1-methylimidazole-4-sulfonamide has a molecular weight of 407.88 g/mol, XLogP of 4.07, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[2-(4-ethoxyphenoxy)phenyl]-1-methylimidazole-4-sulfonamide is sourced from PubChem (CID 55590040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).