4-chloro-3-[(2-methylphenyl)sulfonylamino]benzamide

C14H13ClN2O3S — CID 62999668

IUPAC4-chloro-3-[(2-methylphenyl)sulfonylamino]benzamide
SMILESCc1ccccc1S(=O)(=O)Nc1cc(C(N)=O)ccc1Cl
InChIInChI=1S/C14H13ClN2O3S/c1-9-4-2-3-5-13(9)21(19,20)17-12-8-10(14(16)18)6-7-11(12)15/h2-8,17H,1H3,(H2,16,18)
InChIKeyABBYGLFFVOMDOB-UHFFFAOYSA-N
MW324.79 g/mol
LogP2.55
Rot. Bonds4

About 4-chloro-3-[(2-methylphenyl)sulfonylamino]benzamide

4-chloro-3-[(2-methylphenyl)sulfonylamino]benzamide (PubChem CID 62999668) has the molecular formula C14H13ClN2O3S and a molecular weight of 324.79 g/mol. Its IUPAC name is 4-chloro-3-[(2-methylphenyl)sulfonylamino]benzamide.

Molecular Properties

Compound Name4-chloro-3-[(2-methylphenyl)sulfonylamino]benzamide
PubChem CID62999668
Molecular FormulaC14H13ClN2O3S
Molecular Weight324.79 g/mol
Exact Mass324.03
IUPAC Name4-chloro-3-[(2-methylphenyl)sulfonylamino]benzamide
SMILESCc1ccccc1S(=O)(=O)Nc1cc(C(N)=O)ccc1Cl
InChIInChI=1S/C14H13ClN2O3S/c1-9-4-2-3-5-13(9)21(19,20)17-12-8-10(14(16)18)6-7-11(12)15/h2-8,17H,1H3,(H2,16,18)
InChIKeyABBYGLFFVOMDOB-UHFFFAOYSA-N
XLogP2.55
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.79
LogP ≤ 52.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-chloro-3-[(2-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

4-chloro-3-[(4-chloro-2-methylphenyl)sulfonylamino]benzamide
CID 60531609
3-[(2-methylphenyl)sulfonylamino]benzamide
CID 63000187
4-chloro-3-[(2,5-dichlorothiophen-3-yl)sulfonylamino]benzamide
CID 34973303
4-chloro-3-(sulfamoylamino)benzamide
CID 112573335
4-chloro-3-[(2-methylphenyl)sulfamoyl]benzenecarbothioamide
CID 80694028
4-chloro-3-[(3,4-dimethylphenyl)sulfamoyl]benzamide
CID 1266797
3-[(2-chlorophenyl)sulfonylamino]-4-methylbenzoic acid
CID 4801006
4-fluoro-3-[(2-methylphenyl)sulfonylamino]benzoic acid
CID 63000199
4-chloro-3-[(5-fluoro-2-methylphenyl)sulfonylamino]-N-methylbenzamide
CID 87027257
N-(5-acetyl-2-chlorophenyl)-2,4,5-trichlorobenzenesulfonamide
CID 2742129
N-[2-[(2-methylphenyl)sulfonylamino]phenyl]acetamide
CID 113093732
4-methoxy-3-[(2-methylsulfonylphenyl)sulfonylamino]benzamide
CID 55901057

Frequently Asked Questions

What is the IUPAC name of 4-chloro-3-[(2-methylphenyl)sulfonylamino]benzamide?
The IUPAC name of 4-chloro-3-[(2-methylphenyl)sulfonylamino]benzamide (CID 62999668) is 4-chloro-3-[(2-methylphenyl)sulfonylamino]benzamide.
What is the SMILES notation for 4-chloro-3-[(2-methylphenyl)sulfonylamino]benzamide?
The canonical SMILES for 4-chloro-3-[(2-methylphenyl)sulfonylamino]benzamide is Cc1ccccc1S(=O)(=O)Nc1cc(C(N)=O)ccc1Cl.
What is the InChIKey of 4-chloro-3-[(2-methylphenyl)sulfonylamino]benzamide?
The InChIKey is ABBYGLFFVOMDOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13ClN2O3S/c1-9-4-2-3-5-13(9)21(19,20)17-12-8-10(14(16)18)6-7-11(12)15/h2-8,17H,1H3,(H2,16,18).
What are the key properties of 4-chloro-3-[(2-methylphenyl)sulfonylamino]benzamide?
4-chloro-3-[(2-methylphenyl)sulfonylamino]benzamide has a molecular weight of 324.79 g/mol, XLogP of 2.55, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-3-[(2-methylphenyl)sulfonylamino]benzamide is sourced from PubChem (CID 62999668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).