N-(4-acetylphenyl)-3-[(4-methylphenyl)sulfonylamino]benzamide

C22H20N2O4S — CID 7542008

IUPACN-(4-acetylphenyl)-3-[(4-methylphenyl)sulfonylamino]benzamide
SMILESCC(=O)c1ccc(NC(=O)c2cccc(NS(=O)(=O)c3ccc(C)cc3)c2)cc1
InChIInChI=1S/C22H20N2O4S/c1-15-6-12-21(13-7-15)29(27,28)24-20-5-3-4-18(14-20)22(26)23-19-10-8-17(9-11-19)16(2)25/h3-14,24H,1-2H3,(H,23,26)
InChIKeyNEYBNLPPCGRRBI-UHFFFAOYSA-N
MW408.48 g/mol
LogP4.25
Rot. Bonds6

About N-(4-acetylphenyl)-3-[(4-methylphenyl)sulfonylamino]benzamide

N-(4-acetylphenyl)-3-[(4-methylphenyl)sulfonylamino]benzamide (PubChem CID 7542008) has the molecular formula C22H20N2O4S and a molecular weight of 408.48 g/mol. Its IUPAC name is N-(4-acetylphenyl)-3-[(4-methylphenyl)sulfonylamino]benzamide.

Molecular Properties

Compound NameN-(4-acetylphenyl)-3-[(4-methylphenyl)sulfonylamino]benzamide
PubChem CID7542008
Molecular FormulaC22H20N2O4S
Molecular Weight408.48 g/mol
Exact Mass408.11
IUPAC NameN-(4-acetylphenyl)-3-[(4-methylphenyl)sulfonylamino]benzamide
SMILESCC(=O)c1ccc(NC(=O)c2cccc(NS(=O)(=O)c3ccc(C)cc3)c2)cc1
InChIInChI=1S/C22H20N2O4S/c1-15-6-12-21(13-7-15)29(27,28)24-20-5-3-4-18(14-20)22(26)23-19-10-8-17(9-11-19)16(2)25/h3-14,24H,1-2H3,(H,23,26)
InChIKeyNEYBNLPPCGRRBI-UHFFFAOYSA-N
XLogP4.25
TPSA92.34 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.48
LogP ≤ 54.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(4-acetylphenyl)-3-[(4-methylphenyl)sulfonylamino]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

N-(4-bromophenyl)-3-[(4-methylphenyl)sulfonylamino]benzamide
CID 1287289
3-[(4-methylphenyl)sulfonylamino]-N-naphthalen-2-ylbenzamide
CID 9412821
4-[[3-[(3-acetylphenyl)sulfamoyl]benzoyl]amino]benzoic acid
CID 1355824
N-[4-[(3-chlorophenyl)sulfamoyl]phenyl]-4-[(4-methylphenyl)sulfonylamino]benzamide
CID 3918199
N-(4-methylphenyl)-3-[(4-methylphenyl)sulfamoyl]benzamide
CID 3284384
N-[4-[(4-methylphenyl)sulfonylamino]phenyl]-3-(propan-2-ylcarbamoylamino)benzamide
CID 55649936
N-(4-methylphenyl)-4-[(4-methylphenyl)sulfamoyl]benzamide
CID 2687815
3-[(4-methylphenyl)sulfonylamino]-N-[4-(pyridin-4-ylmethyl)phenyl]benzamide
CID 92505181
3-[(4-acetamidophenyl)sulfonylamino]-N-methylbenzamide
CID 31580637
3-[(4-methoxyphenyl)sulfonylamino]-N-[4-[4-[[3-[(4-methoxyphenyl)sulfonylamino]benzoyl]amino]phenyl]phenyl]benzamide
CID 121043305
N-[4-[(3,4-dimethylphenyl)sulfamoyl]phenyl]-3-methylbenzamide
CID 1310856
3-acetamido-N-[4-[(4-iodophenyl)sulfamoyl]phenyl]benzamide
CID 2114640

Frequently Asked Questions

What is the IUPAC name of N-(4-acetylphenyl)-3-[(4-methylphenyl)sulfonylamino]benzamide?
The IUPAC name of N-(4-acetylphenyl)-3-[(4-methylphenyl)sulfonylamino]benzamide (CID 7542008) is N-(4-acetylphenyl)-3-[(4-methylphenyl)sulfonylamino]benzamide.
What is the SMILES notation for N-(4-acetylphenyl)-3-[(4-methylphenyl)sulfonylamino]benzamide?
The canonical SMILES for N-(4-acetylphenyl)-3-[(4-methylphenyl)sulfonylamino]benzamide is CC(=O)c1ccc(NC(=O)c2cccc(NS(=O)(=O)c3ccc(C)cc3)c2)cc1.
What is the InChIKey of N-(4-acetylphenyl)-3-[(4-methylphenyl)sulfonylamino]benzamide?
The InChIKey is NEYBNLPPCGRRBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N2O4S/c1-15-6-12-21(13-7-15)29(27,28)24-20-5-3-4-18(14-20)22(26)23-19-10-8-17(9-11-19)16(2)25/h3-14,24H,1-2H3,(H,23,26).
What are the key properties of N-(4-acetylphenyl)-3-[(4-methylphenyl)sulfonylamino]benzamide?
N-(4-acetylphenyl)-3-[(4-methylphenyl)sulfonylamino]benzamide has a molecular weight of 408.48 g/mol, XLogP of 4.25, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetylphenyl)-3-[(4-methylphenyl)sulfonylamino]benzamide is sourced from PubChem (CID 7542008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).