4-chloro-N-(2,4-dimethoxyphenyl)-N-methylbenzenesulfonamide

C15H16ClNO4S — CID 99635932

IUPAC4-chloro-N-(2,4-dimethoxyphenyl)-N-methylbenzenesulfonamide
SMILESCOc1ccc(N(C)S(=O)(=O)c2ccc(Cl)cc2)c(OC)c1
InChIInChI=1S/C15H16ClNO4S/c1-17(14-9-6-12(20-2)10-15(14)21-3)22(18,19)13-7-4-11(16)5-8-13/h4-10H,1-3H3
InChIKeyDIVKZYBJMFKEKH-UHFFFAOYSA-N
MW341.82 g/mol
LogP3.18
Rot. Bonds5

About 4-chloro-N-(2,4-dimethoxyphenyl)-N-methylbenzenesulfonamide

4-chloro-N-(2,4-dimethoxyphenyl)-N-methylbenzenesulfonamide (PubChem CID 99635932) has the molecular formula C15H16ClNO4S and a molecular weight of 341.82 g/mol. Its IUPAC name is 4-chloro-N-(2,4-dimethoxyphenyl)-N-methylbenzenesulfonamide.

Molecular Properties

Compound Name4-chloro-N-(2,4-dimethoxyphenyl)-N-methylbenzenesulfonamide
PubChem CID99635932
Molecular FormulaC15H16ClNO4S
Molecular Weight341.82 g/mol
Exact Mass341.05
IUPAC Name4-chloro-N-(2,4-dimethoxyphenyl)-N-methylbenzenesulfonamide
SMILESCOc1ccc(N(C)S(=O)(=O)c2ccc(Cl)cc2)c(OC)c1
InChIInChI=1S/C15H16ClNO4S/c1-17(14-9-6-12(20-2)10-15(14)21-3)22(18,19)13-7-4-11(16)5-8-13/h4-10H,1-3H3
InChIKeyDIVKZYBJMFKEKH-UHFFFAOYSA-N
XLogP3.18
TPSA55.84 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.82
LogP ≤ 53.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 4-chloro-N-(2,4-dimethoxyphenyl)-N-methylbenzenesulfonamide 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-(2,5-dimethoxyphenyl)-3-fluoro-4-methoxy-N-methylbenzenesulfonamide
CID 100543133
2-(N-(4-chlorophenyl)sulfonyl-2,4-dimethoxyanilino)propanoic acid
CID 50895135
N-(2,4-dimethoxyphenyl)-N-methyl-2-oxo-1H-quinoline-6-sulfonamide
CID 22548596
N-(2,4-difluorophenyl)-4-methoxy-N-methylbenzenesulfonamide
CID 3746925
N-(4-chlorophenyl)-3-[(4-chlorophenyl)sulfonyl-methylamino]-4-methoxybenzenesulfonamide
CID 71945709
4-[benzenesulfonyl(methyl)amino]-3-methoxybenzenesulfonamide
CID 34207194
3-[(4-chlorophenyl)sulfonyl-methylamino]-N-(2,6-dimethylphenyl)-4-methoxybenzenesulfonamide
CID 71945704
4-chloro-N-(4-chlorophenyl)-N-[(1S)-1-(2,5-dimethoxyphenyl)ethyl]benzenesulfonamide
CID 93207154
5-chloro-N-(4-fluoro-2-methoxyphenyl)-N-methylpyridine-3-sulfonamide
CID 75496337
3-chloro-4-methoxy-N-(3-methoxyphenyl)-N-methylbenzenesulfonamide
CID 100511071
N-(4-chlorophenyl)-N-[(1S)-1-(2,5-dimethoxyphenyl)ethyl]-4-methoxybenzenesulfonamide
CID 93207406
N-(3,4-difluorophenyl)-4-methoxy-N-methylbenzenesulfonamide
CID 94661208

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(2,4-dimethoxyphenyl)-N-methylbenzenesulfonamide?
The IUPAC name of 4-chloro-N-(2,4-dimethoxyphenyl)-N-methylbenzenesulfonamide (CID 99635932) is 4-chloro-N-(2,4-dimethoxyphenyl)-N-methylbenzenesulfonamide.
What is the SMILES notation for 4-chloro-N-(2,4-dimethoxyphenyl)-N-methylbenzenesulfonamide?
The canonical SMILES for 4-chloro-N-(2,4-dimethoxyphenyl)-N-methylbenzenesulfonamide is COc1ccc(N(C)S(=O)(=O)c2ccc(Cl)cc2)c(OC)c1.
What is the InChIKey of 4-chloro-N-(2,4-dimethoxyphenyl)-N-methylbenzenesulfonamide?
The InChIKey is DIVKZYBJMFKEKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16ClNO4S/c1-17(14-9-6-12(20-2)10-15(14)21-3)22(18,19)13-7-4-11(16)5-8-13/h4-10H,1-3H3.
What are the key properties of 4-chloro-N-(2,4-dimethoxyphenyl)-N-methylbenzenesulfonamide?
4-chloro-N-(2,4-dimethoxyphenyl)-N-methylbenzenesulfonamide has a molecular weight of 341.82 g/mol, XLogP of 3.18, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-(2,4-dimethoxyphenyl)-N-methylbenzenesulfonamide is sourced from PubChem (CID 99635932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).