N-(2,4-dimethoxyphenyl)-3-[methyl(phenyl)sulfamoyl]benzamide

C22H22N2O5S — CID 2709362

IUPACN-(2,4-dimethoxyphenyl)-3-[methyl(phenyl)sulfamoyl]benzamide
SMILESCOc1ccc(NC(=O)c2cccc(S(=O)(=O)N(C)c3ccccc3)c2)c(OC)c1
InChIInChI=1S/C22H22N2O5S/c1-24(17-9-5-4-6-10-17)30(26,27)19-11-7-8-16(14-19)22(25)23-20-13-12-18(28-2)15-21(20)29-3/h4-15H,1-3H3,(H,23,25)
InChIKeyZHODOUVFJUVBGJ-UHFFFAOYSA-N
MW426.49 g/mol
LogP3.78
Rot. Bonds7

About N-(2,4-dimethoxyphenyl)-3-[methyl(phenyl)sulfamoyl]benzamide

N-(2,4-dimethoxyphenyl)-3-[methyl(phenyl)sulfamoyl]benzamide (PubChem CID 2709362) has the molecular formula C22H22N2O5S and a molecular weight of 426.49 g/mol. Its IUPAC name is N-(2,4-dimethoxyphenyl)-3-[methyl(phenyl)sulfamoyl]benzamide.

Molecular Properties

Compound NameN-(2,4-dimethoxyphenyl)-3-[methyl(phenyl)sulfamoyl]benzamide
PubChem CID2709362
Molecular FormulaC22H22N2O5S
Molecular Weight426.49 g/mol
Exact Mass426.12
IUPAC NameN-(2,4-dimethoxyphenyl)-3-[methyl(phenyl)sulfamoyl]benzamide
SMILESCOc1ccc(NC(=O)c2cccc(S(=O)(=O)N(C)c3ccccc3)c2)c(OC)c1
InChIInChI=1S/C22H22N2O5S/c1-24(17-9-5-4-6-10-17)30(26,27)19-11-7-8-16(14-19)22(25)23-20-13-12-18(28-2)15-21(20)29-3/h4-15H,1-3H3,(H,23,25)
InChIKeyZHODOUVFJUVBGJ-UHFFFAOYSA-N
XLogP3.78
TPSA84.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500426.49
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2,5-dimethoxyphenyl)-3-[methyl(phenyl)sulfamoyl]benzamide
CID 46797680
N-[(2,5-dimethoxyphenyl)methyl]-3-[methyl(phenyl)sulfamoyl]benzamide
CID 92844931
3-(benzamidocarbamoyl)-N-(4-methoxyphenyl)-N-methylbenzenesulfonamide
CID 2572195
N-(2-benzylphenyl)-3-[(4-methoxyphenyl)-methylsulfamoyl]benzamide
CID 2399081
N-(2,5-dimethoxyphenyl)-3-(dimethylsulfamoyl)benzamide
CID 2083463
3-[(4-methoxyphenyl)-methylsulfamoyl]-N-methylbenzamide
CID 51156149
N-(4-chloro-2-fluorophenyl)-3-[methyl(phenyl)sulfamoyl]benzamide
CID 2711755
3-[ethyl(phenyl)sulfamoyl]-N-(2-methoxyphenyl)benzamide
CID 26914975
N-[(2-methoxyphenyl)methyl]-3-[methyl(phenyl)sulfamoyl]benzamide
CID 2713335
N-(2,4-dimethoxyphenyl)-3-(2-methoxyethylsulfamoyl)benzamide
CID 109063596
N-(2,5-dichlorophenyl)-3-[methyl(phenyl)sulfamoyl]benzamide
CID 42991866
3-[(4-methoxyphenyl)-methylsulfamoyl]-N-(1-phenylethyl)benzamide
CID 4802997

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethoxyphenyl)-3-[methyl(phenyl)sulfamoyl]benzamide?
The IUPAC name of N-(2,4-dimethoxyphenyl)-3-[methyl(phenyl)sulfamoyl]benzamide (CID 2709362) is N-(2,4-dimethoxyphenyl)-3-[methyl(phenyl)sulfamoyl]benzamide.
What is the SMILES notation for N-(2,4-dimethoxyphenyl)-3-[methyl(phenyl)sulfamoyl]benzamide?
The canonical SMILES for N-(2,4-dimethoxyphenyl)-3-[methyl(phenyl)sulfamoyl]benzamide is COc1ccc(NC(=O)c2cccc(S(=O)(=O)N(C)c3ccccc3)c2)c(OC)c1.
What is the InChIKey of N-(2,4-dimethoxyphenyl)-3-[methyl(phenyl)sulfamoyl]benzamide?
The InChIKey is ZHODOUVFJUVBGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N2O5S/c1-24(17-9-5-4-6-10-17)30(26,27)19-11-7-8-16(14-19)22(25)23-20-13-12-18(28-2)15-21(20)29-3/h4-15H,1-3H3,(H,23,25).
What are the key properties of N-(2,4-dimethoxyphenyl)-3-[methyl(phenyl)sulfamoyl]benzamide?
N-(2,4-dimethoxyphenyl)-3-[methyl(phenyl)sulfamoyl]benzamide has a molecular weight of 426.49 g/mol, XLogP of 3.78, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethoxyphenyl)-3-[methyl(phenyl)sulfamoyl]benzamide is sourced from PubChem (CID 2709362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).