N-benzyl-2-[[3-(dimethylsulfamoyl)benzoyl]amino]benzamide

C23H23N3O4S — CID 100624742

IUPACN-benzyl-2-[[3-(dimethylsulfamoyl)benzoyl]amino]benzamide
SMILESCN(C)S(=O)(=O)c1cccc(C(=O)Nc2ccccc2C(=O)NCc2ccccc2)c1
InChIInChI=1S/C23H23N3O4S/c1-26(2)31(29,30)19-12-8-11-18(15-19)22(27)25-21-14-7-6-13-20(21)23(28)24-16-17-9-4-3-5-10-17/h3-15H,16H2,1-2H3,(H,24,28)(H,25,27)
InChIKeyAXWMEPMVXOXQAR-UHFFFAOYSA-N
MW437.52 g/mol
LogP3.12
Rot. Bonds7

About N-benzyl-2-[[3-(dimethylsulfamoyl)benzoyl]amino]benzamide

N-benzyl-2-[[3-(dimethylsulfamoyl)benzoyl]amino]benzamide (PubChem CID 100624742) has the molecular formula C23H23N3O4S and a molecular weight of 437.52 g/mol. Its IUPAC name is N-benzyl-2-[[3-(dimethylsulfamoyl)benzoyl]amino]benzamide.

Molecular Properties

Compound NameN-benzyl-2-[[3-(dimethylsulfamoyl)benzoyl]amino]benzamide
PubChem CID100624742
Molecular FormulaC23H23N3O4S
Molecular Weight437.52 g/mol
Exact Mass437.14
IUPAC NameN-benzyl-2-[[3-(dimethylsulfamoyl)benzoyl]amino]benzamide
SMILESCN(C)S(=O)(=O)c1cccc(C(=O)Nc2ccccc2C(=O)NCc2ccccc2)c1
InChIInChI=1S/C23H23N3O4S/c1-26(2)31(29,30)19-12-8-11-18(15-19)22(27)25-21-14-7-6-13-20(21)23(28)24-16-17-9-4-3-5-10-17/h3-15H,16H2,1-2H3,(H,24,28)(H,25,27)
InChIKeyAXWMEPMVXOXQAR-UHFFFAOYSA-N
XLogP3.12
TPSA95.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500437.52
LogP ≤ 53.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-benzyl-2-[[3-(dimethylsulfamoyl)benzoyl]amino]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-benzyl-2-[[3-(methylsulfamoyl)benzoyl]amino]benzamide
CID 100620245
2-[[3-(dimethylsulfamoyl)benzoyl]amino]-N-(furan-2-ylmethyl)benzamide
CID 95295267
N-butan-2-yl-2-[[3-(dimethylsulfamoyl)benzoyl]amino]benzamide
CID 133231331
3-(dimethylsulfamoyl)-N-(2-methylphenyl)benzamide
CID 2221549
N-benzyl-2-[(3-ethoxybenzoyl)amino]benzamide
CID 4957453
N-[2-(2-amino-2-oxoethyl)phenyl]-3-(dimethylsulfamoyl)benzamide
CID 55603942
2-[[3-[methoxy(methyl)sulfamoyl]benzoyl]amino]-N-(2-methylpropyl)benzamide
CID 34731063
N-[[4-(dimethylsulfamoyl)phenyl]methyl]-3-methylsulfonylbenzamide
CID 55846283
3-(dimethylsulfamoyl)-N-(2-ethoxyphenyl)benzamide
CID 2591093
N-benzyl-2-[(3-propoxybenzoyl)amino]benzamide
CID 4960084
2-[[3-(dipropylsulfamoyl)benzoyl]amino]benzoic acid
CID 45340807
[4-[[[3-(dimethylsulfamoyl)benzoyl]amino]methyl]phenyl]methyl-diethylazanium
CID 8947695

Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-[[3-(dimethylsulfamoyl)benzoyl]amino]benzamide?
The IUPAC name of N-benzyl-2-[[3-(dimethylsulfamoyl)benzoyl]amino]benzamide (CID 100624742) is N-benzyl-2-[[3-(dimethylsulfamoyl)benzoyl]amino]benzamide.
What is the SMILES notation for N-benzyl-2-[[3-(dimethylsulfamoyl)benzoyl]amino]benzamide?
The canonical SMILES for N-benzyl-2-[[3-(dimethylsulfamoyl)benzoyl]amino]benzamide is CN(C)S(=O)(=O)c1cccc(C(=O)Nc2ccccc2C(=O)NCc2ccccc2)c1.
What is the InChIKey of N-benzyl-2-[[3-(dimethylsulfamoyl)benzoyl]amino]benzamide?
The InChIKey is AXWMEPMVXOXQAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3O4S/c1-26(2)31(29,30)19-12-8-11-18(15-19)22(27)25-21-14-7-6-13-20(21)23(28)24-16-17-9-4-3-5-10-17/h3-15H,16H2,1-2H3,(H,24,28)(H,25,27).
What are the key properties of N-benzyl-2-[[3-(dimethylsulfamoyl)benzoyl]amino]benzamide?
N-benzyl-2-[[3-(dimethylsulfamoyl)benzoyl]amino]benzamide has a molecular weight of 437.52 g/mol, XLogP of 3.12, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-[[3-(dimethylsulfamoyl)benzoyl]amino]benzamide is sourced from PubChem (CID 100624742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).