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

C13H11ClN2O3S — CID 754262

IUPAC4-chloro-N-(4-sulfamoylphenyl)benzamide
SMILESNS(=O)(=O)c1ccc(NC(=O)c2ccc(Cl)cc2)cc1
InChIInChI=1S/C13H11ClN2O3S/c14-10-3-1-9(2-4-10)13(17)16-11-5-7-12(8-6-11)20(15,18)19/h1-8H,(H,16,17)(H2,15,18,19)
InChIKeyCANLLCCTMYQFSE-UHFFFAOYSA-N
MW310.76 g/mol
LogP2.24
Rot. Bonds3

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

4-chloro-N-(4-sulfamoylphenyl)benzamide (PubChem CID 754262) has the molecular formula C13H11ClN2O3S and a molecular weight of 310.76 g/mol. Its IUPAC name is 4-chloro-N-(4-sulfamoylphenyl)benzamide.

Molecular Properties

Compound Name4-chloro-N-(4-sulfamoylphenyl)benzamide
PubChem CID754262
Molecular FormulaC13H11ClN2O3S
Molecular Weight310.76 g/mol
Exact Mass310.02
IUPAC Name4-chloro-N-(4-sulfamoylphenyl)benzamide
SMILESNS(=O)(=O)c1ccc(NC(=O)c2ccc(Cl)cc2)cc1
InChIInChI=1S/C13H11ClN2O3S/c14-10-3-1-9(2-4-10)13(17)16-11-5-7-12(8-6-11)20(15,18)19/h1-8H,(H,16,17)(H2,15,18,19)
InChIKeyCANLLCCTMYQFSE-UHFFFAOYSA-N
XLogP2.24
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.76
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(4-sulfamoylphenyl)benzamide?
The IUPAC name of 4-chloro-N-(4-sulfamoylphenyl)benzamide (CID 754262) is 4-chloro-N-(4-sulfamoylphenyl)benzamide.
What is the SMILES notation for 4-chloro-N-(4-sulfamoylphenyl)benzamide?
The canonical SMILES for 4-chloro-N-(4-sulfamoylphenyl)benzamide is NS(=O)(=O)c1ccc(NC(=O)c2ccc(Cl)cc2)cc1.
What is the InChIKey of 4-chloro-N-(4-sulfamoylphenyl)benzamide?
The InChIKey is CANLLCCTMYQFSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11ClN2O3S/c14-10-3-1-9(2-4-10)13(17)16-11-5-7-12(8-6-11)20(15,18)19/h1-8H,(H,16,17)(H2,15,18,19).
What are the key properties of 4-chloro-N-(4-sulfamoylphenyl)benzamide?
4-chloro-N-(4-sulfamoylphenyl)benzamide has a molecular weight of 310.76 g/mol, XLogP of 2.24, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-(4-sulfamoylphenyl)benzamide is sourced from PubChem (CID 754262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).