4-(dimethylsulfamoyl)-N-(4-methylsulfonylphenyl)benzamide

C16H18N2O5S2 — CID 4845311

IUPAC4-(dimethylsulfamoyl)-N-(4-methylsulfonylphenyl)benzamide
SMILESCN(C)S(=O)(=O)c1ccc(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cc1
InChIInChI=1S/C16H18N2O5S2/c1-18(2)25(22,23)15-8-4-12(5-9-15)16(19)17-13-6-10-14(11-7-13)24(3,20)21/h4-11H,1-3H3,(H,17,19)
InChIKeyHEOMJGAVFFFSOE-UHFFFAOYSA-N
MW382.46 g/mol
LogP1.59
Rot. Bonds5

About 4-(dimethylsulfamoyl)-N-(4-methylsulfonylphenyl)benzamide

4-(dimethylsulfamoyl)-N-(4-methylsulfonylphenyl)benzamide (PubChem CID 4845311) has the molecular formula C16H18N2O5S2 and a molecular weight of 382.46 g/mol. Its IUPAC name is 4-(dimethylsulfamoyl)-N-(4-methylsulfonylphenyl)benzamide.

Molecular Properties

Compound Name4-(dimethylsulfamoyl)-N-(4-methylsulfonylphenyl)benzamide
PubChem CID4845311
Molecular FormulaC16H18N2O5S2
Molecular Weight382.46 g/mol
Exact Mass382.07
IUPAC Name4-(dimethylsulfamoyl)-N-(4-methylsulfonylphenyl)benzamide
SMILESCN(C)S(=O)(=O)c1ccc(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cc1
InChIInChI=1S/C16H18N2O5S2/c1-18(2)25(22,23)15-8-4-12(5-9-15)16(19)17-13-6-10-14(11-7-13)24(3,20)21/h4-11H,1-3H3,(H,17,19)
InChIKeyHEOMJGAVFFFSOE-UHFFFAOYSA-N
XLogP1.59
TPSA100.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.46
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-[[4-(dimethylsulfamoyl)benzoyl]amino]benzoate
CID 6978549
N-[4-(carbamoylamino)phenyl]-4-(dimethylsulfamoyl)benzamide
CID 33152473
N-[4-(dimethylamino)phenyl]-4-(dimethylsulfamoyl)benzamide
CID 110756571
N-[3-(dimethylsulfamoyl)phenyl]-4-methylsulfonylbenzamide
CID 9093665
4-(dimethylsulfamoyl)-N-[4-(phenylcarbamoylamino)phenyl]benzamide
CID 18289472
N-[4-(dimethylsulfamoyl)phenyl]-4-nitrobenzamide
CID 2672860
N-[4-(dimethylsulfamoyl)phenyl]-4-ethoxybenzamide
CID 2672905
4-(dimethylsulfamoyl)-N-[4-(phenylsulfamoyl)phenyl]benzamide
CID 24638138
N-[4-(butylamino)phenyl]-4-(dimethylsulfamoyl)benzamide
CID 112980242
[2-[4-(dimethylsulfamoyl)anilino]-2-oxoethyl] 4-methylsulfonylbenzoate
CID 16514566
4-methylsulfonyl-N-(4-phenylphenyl)benzamide
CID 7998967
4-(dimethylsulfamoyl)-N-(4-fluoro-3-methylphenyl)benzamide
CID 110776363

Frequently Asked Questions

What is the IUPAC name of 4-(dimethylsulfamoyl)-N-(4-methylsulfonylphenyl)benzamide?
The IUPAC name of 4-(dimethylsulfamoyl)-N-(4-methylsulfonylphenyl)benzamide (CID 4845311) is 4-(dimethylsulfamoyl)-N-(4-methylsulfonylphenyl)benzamide.
What is the SMILES notation for 4-(dimethylsulfamoyl)-N-(4-methylsulfonylphenyl)benzamide?
The canonical SMILES for 4-(dimethylsulfamoyl)-N-(4-methylsulfonylphenyl)benzamide is CN(C)S(=O)(=O)c1ccc(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cc1.
What is the InChIKey of 4-(dimethylsulfamoyl)-N-(4-methylsulfonylphenyl)benzamide?
The InChIKey is HEOMJGAVFFFSOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O5S2/c1-18(2)25(22,23)15-8-4-12(5-9-15)16(19)17-13-6-10-14(11-7-13)24(3,20)21/h4-11H,1-3H3,(H,17,19).
What are the key properties of 4-(dimethylsulfamoyl)-N-(4-methylsulfonylphenyl)benzamide?
4-(dimethylsulfamoyl)-N-(4-methylsulfonylphenyl)benzamide has a molecular weight of 382.46 g/mol, XLogP of 1.59, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylsulfamoyl)-N-(4-methylsulfonylphenyl)benzamide is sourced from PubChem (CID 4845311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).