4-chloro-2,5-dimethoxy-N-(2-methylphenyl)benzenesulfonamide

C15H16ClNO4S — CID 163343299

IUPAC4-chloro-2,5-dimethoxy-N-(2-methylphenyl)benzenesulfonamide
SMILESCOc1cc(S(=O)(=O)Nc2ccccc2C)c(OC)cc1Cl
InChIInChI=1S/C15H16ClNO4S/c1-10-6-4-5-7-12(10)17-22(18,19)15-9-13(20-2)11(16)8-14(15)21-3/h4-9,17H,1-3H3
InChIKeyAGWMGAJUTHHFBX-UHFFFAOYSA-N
MW341.82 g/mol
LogP3.47
Rot. Bonds5

About 4-chloro-2,5-dimethoxy-N-(2-methylphenyl)benzenesulfonamide

4-chloro-2,5-dimethoxy-N-(2-methylphenyl)benzenesulfonamide (PubChem CID 163343299) has the molecular formula C15H16ClNO4S and a molecular weight of 341.82 g/mol. Its IUPAC name is 4-chloro-2,5-dimethoxy-N-(2-methylphenyl)benzenesulfonamide.

Molecular Properties

Compound Name4-chloro-2,5-dimethoxy-N-(2-methylphenyl)benzenesulfonamide
PubChem CID163343299
Molecular FormulaC15H16ClNO4S
Molecular Weight341.82 g/mol
Exact Mass341.05
IUPAC Name4-chloro-2,5-dimethoxy-N-(2-methylphenyl)benzenesulfonamide
SMILESCOc1cc(S(=O)(=O)Nc2ccccc2C)c(OC)cc1Cl
InChIInChI=1S/C15H16ClNO4S/c1-10-6-4-5-7-12(10)17-22(18,19)15-9-13(20-2)11(16)8-14(15)21-3/h4-9,17H,1-3H3
InChIKeyAGWMGAJUTHHFBX-UHFFFAOYSA-N
XLogP3.47
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.82
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-chloro-2,5-dimethoxy-N-(2-methylphenyl)benzenesulfonamide 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

2,5-dichloro-4-methoxy-N-(2-methylphenyl)benzenesulfonamide
CID 1258973
N-[2-(methanesulfonamido)phenyl]-2-methoxy-4,5-dimethylbenzenesulfonamide
CID 113093442
5-chloro-N-(2-ethoxyphenyl)-2-methoxy-4-methylbenzenesulfonamide
CID 9267445
4,6-dimethoxy-1-N,3-N-bis(2-methoxyphenyl)benzene-1,3-disulfonamide
CID 17349147
methyl 2-[(2-methoxy-4,5-dimethylphenyl)sulfonylamino]benzoate
CID 27242666
5-bromo-N-(4-chloro-2,5-dimethoxyphenyl)-2-methylbenzenesulfonamide
CID 27993653
N-(4-chloro-2,5-dimethoxyphenyl)benzenesulfonamide
CID 710996
4-chloro-2,5-dimethoxy-N-[(1S)-1-phenylethyl]benzenesulfonamide
CID 991853
4-bromo-N-(4-chloro-2,5-dimethoxyphenyl)-2,5-dimethylbenzenesulfonamide
CID 171699229
2,5-dichloro-N-(4-chloro-2,5-dimethoxyphenyl)benzenesulfonamide
CID 1005068
4-[(4-chloro-2,5-dimethoxyphenyl)sulfonylamino]benzoic acid
CID 15944041
2-methoxy-N-(2-methylphenyl)-4-(1,2-oxazol-5-yl)benzenesulfonamide
CID 53094896

Frequently Asked Questions

What is the IUPAC name of 4-chloro-2,5-dimethoxy-N-(2-methylphenyl)benzenesulfonamide?
The IUPAC name of 4-chloro-2,5-dimethoxy-N-(2-methylphenyl)benzenesulfonamide (CID 163343299) is 4-chloro-2,5-dimethoxy-N-(2-methylphenyl)benzenesulfonamide.
What is the SMILES notation for 4-chloro-2,5-dimethoxy-N-(2-methylphenyl)benzenesulfonamide?
The canonical SMILES for 4-chloro-2,5-dimethoxy-N-(2-methylphenyl)benzenesulfonamide is COc1cc(S(=O)(=O)Nc2ccccc2C)c(OC)cc1Cl.
What is the InChIKey of 4-chloro-2,5-dimethoxy-N-(2-methylphenyl)benzenesulfonamide?
The InChIKey is AGWMGAJUTHHFBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16ClNO4S/c1-10-6-4-5-7-12(10)17-22(18,19)15-9-13(20-2)11(16)8-14(15)21-3/h4-9,17H,1-3H3.
What are the key properties of 4-chloro-2,5-dimethoxy-N-(2-methylphenyl)benzenesulfonamide?
4-chloro-2,5-dimethoxy-N-(2-methylphenyl)benzenesulfonamide has a molecular weight of 341.82 g/mol, XLogP of 3.47, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2,5-dimethoxy-N-(2-methylphenyl)benzenesulfonamide is sourced from PubChem (CID 163343299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).