4-(dimethylsulfamoyl)-N-[4-(phenylsulfamoyl)phenyl]benzamide

C21H21N3O5S2 — CID 24638138

IUPAC4-(dimethylsulfamoyl)-N-[4-(phenylsulfamoyl)phenyl]benzamide
SMILESCN(C)S(=O)(=O)c1ccc(C(=O)Nc2ccc(S(=O)(=O)Nc3ccccc3)cc2)cc1
InChIInChI=1S/C21H21N3O5S2/c1-24(2)31(28,29)20-12-8-16(9-13-20)21(25)22-17-10-14-19(15-11-17)30(26,27)23-18-6-4-3-5-7-18/h3-15,23H,1-2H3,(H,22,25)
InChIKeyALTXWFHSWKULBL-UHFFFAOYSA-N
MW459.55 g/mol
LogP2.99
Rot. Bonds7

About 4-(dimethylsulfamoyl)-N-[4-(phenylsulfamoyl)phenyl]benzamide

4-(dimethylsulfamoyl)-N-[4-(phenylsulfamoyl)phenyl]benzamide (PubChem CID 24638138) has the molecular formula C21H21N3O5S2 and a molecular weight of 459.55 g/mol. Its IUPAC name is 4-(dimethylsulfamoyl)-N-[4-(phenylsulfamoyl)phenyl]benzamide.

Molecular Properties

Compound Name4-(dimethylsulfamoyl)-N-[4-(phenylsulfamoyl)phenyl]benzamide
PubChem CID24638138
Molecular FormulaC21H21N3O5S2
Molecular Weight459.55 g/mol
Exact Mass459.09
IUPAC Name4-(dimethylsulfamoyl)-N-[4-(phenylsulfamoyl)phenyl]benzamide
SMILESCN(C)S(=O)(=O)c1ccc(C(=O)Nc2ccc(S(=O)(=O)Nc3ccccc3)cc2)cc1
InChIInChI=1S/C21H21N3O5S2/c1-24(2)31(28,29)20-12-8-16(9-13-20)21(25)22-17-10-14-19(15-11-17)30(26,27)23-18-6-4-3-5-7-18/h3-15,23H,1-2H3,(H,22,25)
InChIKeyALTXWFHSWKULBL-UHFFFAOYSA-N
XLogP2.99
TPSA112.65 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500459.55
LogP ≤ 52.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 4-(dimethylsulfamoyl)-N-[4-(phenylsulfamoyl)phenyl]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-(dimethylsulfamoyl)-N-[4-(phenylcarbamoylamino)phenyl]benzamide
CID 18289472
4-(dimethylsulfamoyl)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzamide
CID 4671821
N-[4-[(3,4-difluorophenyl)sulfonylamino]phenyl]-4-(dimethylsulfamoyl)benzamide
CID 24636547
N-[4-(diethylamino)phenyl]-4-(phenylsulfamoyl)benzamide
CID 27229305
N-[4-(carbamoylamino)phenyl]-4-(dimethylsulfamoyl)benzamide
CID 33152473
4-[[4-(dimethylsulfamoyl)benzoyl]amino]benzoate
CID 6978549
4-(dimethylsulfamoyl)-N-(4-methylsulfonylphenyl)benzamide
CID 4845311
4-[benzenesulfonyl(methyl)amino]-N-[4-[(4-methoxyphenyl)sulfamoyl]phenyl]benzamide
CID 43882282
N-[4-(dimethylamino)phenyl]-4-(dimethylsulfamoyl)benzamide
CID 110756571
4-[benzenesulfonyl(methyl)amino]-N-[4-[(3-methylphenyl)sulfamoyl]phenyl]benzamide
CID 43879853
N-(4-methylphenyl)-4-[(4-methylphenyl)sulfamoyl]benzamide
CID 2687815
4-ethoxy-N-[4-(phenylsulfamoyl)phenyl]benzamide
CID 4948543

Frequently Asked Questions

What is the IUPAC name of 4-(dimethylsulfamoyl)-N-[4-(phenylsulfamoyl)phenyl]benzamide?
The IUPAC name of 4-(dimethylsulfamoyl)-N-[4-(phenylsulfamoyl)phenyl]benzamide (CID 24638138) is 4-(dimethylsulfamoyl)-N-[4-(phenylsulfamoyl)phenyl]benzamide.
What is the SMILES notation for 4-(dimethylsulfamoyl)-N-[4-(phenylsulfamoyl)phenyl]benzamide?
The canonical SMILES for 4-(dimethylsulfamoyl)-N-[4-(phenylsulfamoyl)phenyl]benzamide is CN(C)S(=O)(=O)c1ccc(C(=O)Nc2ccc(S(=O)(=O)Nc3ccccc3)cc2)cc1.
What is the InChIKey of 4-(dimethylsulfamoyl)-N-[4-(phenylsulfamoyl)phenyl]benzamide?
The InChIKey is ALTXWFHSWKULBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21N3O5S2/c1-24(2)31(28,29)20-12-8-16(9-13-20)21(25)22-17-10-14-19(15-11-17)30(26,27)23-18-6-4-3-5-7-18/h3-15,23H,1-2H3,(H,22,25).
What are the key properties of 4-(dimethylsulfamoyl)-N-[4-(phenylsulfamoyl)phenyl]benzamide?
4-(dimethylsulfamoyl)-N-[4-(phenylsulfamoyl)phenyl]benzamide has a molecular weight of 459.55 g/mol, XLogP of 2.99, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylsulfamoyl)-N-[4-(phenylsulfamoyl)phenyl]benzamide is sourced from PubChem (CID 24638138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).