4-[(2,3-dimethylphenyl)sulfamoyl]-N-(4-methoxyphenyl)benzamide

C22H22N2O4S — CID 9411974

IUPAC4-[(2,3-dimethylphenyl)sulfamoyl]-N-(4-methoxyphenyl)benzamide
SMILESCOc1ccc(NC(=O)c2ccc(S(=O)(=O)Nc3cccc(C)c3C)cc2)cc1
InChIInChI=1S/C22H22N2O4S/c1-15-5-4-6-21(16(15)2)24-29(26,27)20-13-7-17(8-14-20)22(25)23-18-9-11-19(28-3)12-10-18/h4-14,24H,1-3H3,(H,23,25)
InChIKeyKSGFNURXOWZXLF-UHFFFAOYSA-N
MW410.50 g/mol
LogP4.37
Rot. Bonds6

About 4-[(2,3-dimethylphenyl)sulfamoyl]-N-(4-methoxyphenyl)benzamide

4-[(2,3-dimethylphenyl)sulfamoyl]-N-(4-methoxyphenyl)benzamide (PubChem CID 9411974) has the molecular formula C22H22N2O4S and a molecular weight of 410.50 g/mol. Its IUPAC name is 4-[(2,3-dimethylphenyl)sulfamoyl]-N-(4-methoxyphenyl)benzamide.

Molecular Properties

Compound Name4-[(2,3-dimethylphenyl)sulfamoyl]-N-(4-methoxyphenyl)benzamide
PubChem CID9411974
Molecular FormulaC22H22N2O4S
Molecular Weight410.50 g/mol
Exact Mass410.13
IUPAC Name4-[(2,3-dimethylphenyl)sulfamoyl]-N-(4-methoxyphenyl)benzamide
SMILESCOc1ccc(NC(=O)c2ccc(S(=O)(=O)Nc3cccc(C)c3C)cc2)cc1
InChIInChI=1S/C22H22N2O4S/c1-15-5-4-6-21(16(15)2)24-29(26,27)20-13-7-17(8-14-20)22(25)23-18-9-11-19(28-3)12-10-18/h4-14,24H,1-3H3,(H,23,25)
InChIKeyKSGFNURXOWZXLF-UHFFFAOYSA-N
XLogP4.37
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.50
LogP ≤ 54.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-[(2,3-dimethylphenyl)sulfamoyl]-N-(4-methoxyphenyl)benzamide 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

4-[(2,3-dimethylphenyl)sulfamoyl]-N-(3,4,5-trimethoxyphenyl)benzamide
CID 27258631
1-(4-methoxyphenyl)-3-[4-[(2-methylphenyl)sulfamoyl]phenyl]urea
CID 1405682
N-(2,3-dimethylphenyl)-4-[(4-ethoxyphenyl)sulfonylamino]benzamide
CID 26538532
N-[2-[(4-methoxyphenyl)sulfonylamino]phenyl]benzamide
CID 15294862
4-[(2-methylphenyl)sulfamoyl]-N-[4-(trifluoromethoxy)phenyl]benzamide
CID 26643217
N-(3,4-dimethylphenyl)-4-[(4-methoxyphenyl)sulfamoyl]benzamide
CID 26593901
N-(3-methoxyphenyl)-4-[(4-methoxyphenyl)sulfonylamino]benzamide
CID 7553556
4-hydroxy-N-[2-[(4-methoxyphenyl)sulfonylamino]phenyl]benzamide
CID 15294835
4-(benzenesulfonamido)-N-(2,3-dimethylphenyl)benzamide
CID 1252770
4-(benzenesulfonamido)-N-[4-[(2-methylphenyl)sulfamoyl]phenyl]benzamide
CID 17052595
N-(4-methoxyphenyl)-4-(propan-2-ylsulfamoyl)benzamide
CID 25400706
N-(2-methoxyphenyl)-4-[(4-methoxyphenyl)sulfonylamino]benzamide
CID 7939173

Frequently Asked Questions

What is the IUPAC name of 4-[(2,3-dimethylphenyl)sulfamoyl]-N-(4-methoxyphenyl)benzamide?
The IUPAC name of 4-[(2,3-dimethylphenyl)sulfamoyl]-N-(4-methoxyphenyl)benzamide (CID 9411974) is 4-[(2,3-dimethylphenyl)sulfamoyl]-N-(4-methoxyphenyl)benzamide.
What is the SMILES notation for 4-[(2,3-dimethylphenyl)sulfamoyl]-N-(4-methoxyphenyl)benzamide?
The canonical SMILES for 4-[(2,3-dimethylphenyl)sulfamoyl]-N-(4-methoxyphenyl)benzamide is COc1ccc(NC(=O)c2ccc(S(=O)(=O)Nc3cccc(C)c3C)cc2)cc1.
What is the InChIKey of 4-[(2,3-dimethylphenyl)sulfamoyl]-N-(4-methoxyphenyl)benzamide?
The InChIKey is KSGFNURXOWZXLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N2O4S/c1-15-5-4-6-21(16(15)2)24-29(26,27)20-13-7-17(8-14-20)22(25)23-18-9-11-19(28-3)12-10-18/h4-14,24H,1-3H3,(H,23,25).
What are the key properties of 4-[(2,3-dimethylphenyl)sulfamoyl]-N-(4-methoxyphenyl)benzamide?
4-[(2,3-dimethylphenyl)sulfamoyl]-N-(4-methoxyphenyl)benzamide has a molecular weight of 410.50 g/mol, XLogP of 4.37, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2,3-dimethylphenyl)sulfamoyl]-N-(4-methoxyphenyl)benzamide is sourced from PubChem (CID 9411974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).