4-chloro-N-(2-chloro-4-sulfamoylphenyl)benzamide

C13H10Cl2N2O3S — CID 43134088

IUPAC4-chloro-N-(2-chloro-4-sulfamoylphenyl)benzamide
SMILESNS(=O)(=O)c1ccc(NC(=O)c2ccc(Cl)cc2)c(Cl)c1
InChIInChI=1S/C13H10Cl2N2O3S/c14-9-3-1-8(2-4-9)13(18)17-12-6-5-10(7-11(12)15)21(16,19)20/h1-7H,(H,17,18)(H2,16,19,20)
InChIKeyPQXPHVXEKDLWCF-UHFFFAOYSA-N
MW345.21 g/mol
LogP2.89
Rot. Bonds3

About 4-chloro-N-(2-chloro-4-sulfamoylphenyl)benzamide

4-chloro-N-(2-chloro-4-sulfamoylphenyl)benzamide (PubChem CID 43134088) has the molecular formula C13H10Cl2N2O3S and a molecular weight of 345.21 g/mol. Its IUPAC name is 4-chloro-N-(2-chloro-4-sulfamoylphenyl)benzamide.

Molecular Properties

Compound Name4-chloro-N-(2-chloro-4-sulfamoylphenyl)benzamide
PubChem CID43134088
Molecular FormulaC13H10Cl2N2O3S
Molecular Weight345.21 g/mol
Exact Mass343.98
IUPAC Name4-chloro-N-(2-chloro-4-sulfamoylphenyl)benzamide
SMILESNS(=O)(=O)c1ccc(NC(=O)c2ccc(Cl)cc2)c(Cl)c1
InChIInChI=1S/C13H10Cl2N2O3S/c14-9-3-1-8(2-4-9)13(18)17-12-6-5-10(7-11(12)15)21(16,19)20/h1-7H,(H,17,18)(H2,16,19,20)
InChIKeyPQXPHVXEKDLWCF-UHFFFAOYSA-N
XLogP2.89
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.21
LogP ≤ 52.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(2-chloro-4-sulfamoylphenyl)benzamide?
The IUPAC name of 4-chloro-N-(2-chloro-4-sulfamoylphenyl)benzamide (CID 43134088) is 4-chloro-N-(2-chloro-4-sulfamoylphenyl)benzamide.
What is the SMILES notation for 4-chloro-N-(2-chloro-4-sulfamoylphenyl)benzamide?
The canonical SMILES for 4-chloro-N-(2-chloro-4-sulfamoylphenyl)benzamide is NS(=O)(=O)c1ccc(NC(=O)c2ccc(Cl)cc2)c(Cl)c1.
What is the InChIKey of 4-chloro-N-(2-chloro-4-sulfamoylphenyl)benzamide?
The InChIKey is PQXPHVXEKDLWCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10Cl2N2O3S/c14-9-3-1-8(2-4-9)13(18)17-12-6-5-10(7-11(12)15)21(16,19)20/h1-7H,(H,17,18)(H2,16,19,20).
What are the key properties of 4-chloro-N-(2-chloro-4-sulfamoylphenyl)benzamide?
4-chloro-N-(2-chloro-4-sulfamoylphenyl)benzamide has a molecular weight of 345.21 g/mol, XLogP of 2.89, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-(2-chloro-4-sulfamoylphenyl)benzamide is sourced from PubChem (CID 43134088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).