N-(5-chloro-2,4-dimethoxyphenyl)-4-(dimethylamino)benzenesulfonamide

C16H19ClN2O4S — CID 167884327

IUPACN-(5-chloro-2,4-dimethoxyphenyl)-4-(dimethylamino)benzenesulfonamide
SMILESCOc1cc(OC)c(NS(=O)(=O)c2ccc(N(C)C)cc2)cc1Cl
InChIInChI=1S/C16H19ClN2O4S/c1-19(2)11-5-7-12(8-6-11)24(20,21)18-14-9-13(17)15(22-3)10-16(14)23-4/h5-10,18H,1-4H3
InChIKeyMWBULQZWPSWERM-UHFFFAOYSA-N
MW370.86 g/mol
LogP3.22
Rot. Bonds6

About N-(5-chloro-2,4-dimethoxyphenyl)-4-(dimethylamino)benzenesulfonamide

N-(5-chloro-2,4-dimethoxyphenyl)-4-(dimethylamino)benzenesulfonamide (PubChem CID 167884327) has the molecular formula C16H19ClN2O4S and a molecular weight of 370.86 g/mol. Its IUPAC name is N-(5-chloro-2,4-dimethoxyphenyl)-4-(dimethylamino)benzenesulfonamide.

Molecular Properties

Compound NameN-(5-chloro-2,4-dimethoxyphenyl)-4-(dimethylamino)benzenesulfonamide
PubChem CID167884327
Molecular FormulaC16H19ClN2O4S
Molecular Weight370.86 g/mol
Exact Mass370.08
IUPAC NameN-(5-chloro-2,4-dimethoxyphenyl)-4-(dimethylamino)benzenesulfonamide
SMILESCOc1cc(OC)c(NS(=O)(=O)c2ccc(N(C)C)cc2)cc1Cl
InChIInChI=1S/C16H19ClN2O4S/c1-19(2)11-5-7-12(8-6-11)24(20,21)18-14-9-13(17)15(22-3)10-16(14)23-4/h5-10,18H,1-4H3
InChIKeyMWBULQZWPSWERM-UHFFFAOYSA-N
XLogP3.22
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.86
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(5-chloro-2,4-dimethoxyphenyl)-4-(dimethylamino)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

N-[4-(dimethylamino)-2-methoxyphenyl]-4-methylbenzenesulfonamide
CID 169371060
N-(4-chloro-2,5-dimethoxyphenyl)benzenesulfonamide
CID 710996
N-(5-chloro-2,4-dimethoxyphenyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
CID 7938312
N-(5-chloro-2,4-dimethoxyphenyl)-5,6,7,8-tetrahydronaphthalene-2-sulfonamide
CID 7510365
1-chloro-5-(dimethylsulfamoylamino)-2,4-dimethoxybenzene
CID 35767285
N-(5-chloro-2,4-dimethoxyphenyl)-2-oxo-1,3-dihydrobenzimidazole-5-sulfonamide
CID 7602669
N-(4-chloro-2,5-dimethoxyphenyl)-4-(2-methylpropyl)benzenesulfonamide
CID 22774049
N-(5-chloro-2,4-dimethoxyphenyl)-4-(2-methyl-1,3-oxazol-4-yl)benzenesulfonamide
CID 22583055
4-methyl-N-(2,4,5-trimethoxyphenyl)benzenesulfonamide
CID 101056071
N-(4-chloro-2,5-dimethoxyphenyl)-4-(cyclopropanecarbonyl)benzenesulfonamide
CID 110427928
4-butyl-N-(4-chloro-2,5-dimethoxyphenyl)benzenesulfonamide
CID 22774048
3-chloro-N-(5-chloro-2-methoxyphenyl)-4-methoxybenzenesulfonamide
CID 5202468

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2,4-dimethoxyphenyl)-4-(dimethylamino)benzenesulfonamide?
The IUPAC name of N-(5-chloro-2,4-dimethoxyphenyl)-4-(dimethylamino)benzenesulfonamide (CID 167884327) is N-(5-chloro-2,4-dimethoxyphenyl)-4-(dimethylamino)benzenesulfonamide.
What is the SMILES notation for N-(5-chloro-2,4-dimethoxyphenyl)-4-(dimethylamino)benzenesulfonamide?
The canonical SMILES for N-(5-chloro-2,4-dimethoxyphenyl)-4-(dimethylamino)benzenesulfonamide is COc1cc(OC)c(NS(=O)(=O)c2ccc(N(C)C)cc2)cc1Cl.
What is the InChIKey of N-(5-chloro-2,4-dimethoxyphenyl)-4-(dimethylamino)benzenesulfonamide?
The InChIKey is MWBULQZWPSWERM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19ClN2O4S/c1-19(2)11-5-7-12(8-6-11)24(20,21)18-14-9-13(17)15(22-3)10-16(14)23-4/h5-10,18H,1-4H3.
What are the key properties of N-(5-chloro-2,4-dimethoxyphenyl)-4-(dimethylamino)benzenesulfonamide?
N-(5-chloro-2,4-dimethoxyphenyl)-4-(dimethylamino)benzenesulfonamide has a molecular weight of 370.86 g/mol, XLogP of 3.22, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2,4-dimethoxyphenyl)-4-(dimethylamino)benzenesulfonamide is sourced from PubChem (CID 167884327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).