2,5-dichloro-N-(4-sulfamoylphenyl)benzamide

C13H10Cl2N2O3S — CID 669678

IUPAC2,5-dichloro-N-(4-sulfamoylphenyl)benzamide
SMILESNS(=O)(=O)c1ccc(NC(=O)c2cc(Cl)ccc2Cl)cc1
InChIInChI=1S/C13H10Cl2N2O3S/c14-8-1-6-12(15)11(7-8)13(18)17-9-2-4-10(5-3-9)21(16,19)20/h1-7H,(H,17,18)(H2,16,19,20)
InChIKeyRSVJZQGBMDWJAE-UHFFFAOYSA-N
MW345.21 g/mol
LogP2.89
Rot. Bonds3

About 2,5-dichloro-N-(4-sulfamoylphenyl)benzamide

2,5-dichloro-N-(4-sulfamoylphenyl)benzamide (PubChem CID 669678) has the molecular formula C13H10Cl2N2O3S and a molecular weight of 345.21 g/mol. Its IUPAC name is 2,5-dichloro-N-(4-sulfamoylphenyl)benzamide.

Molecular Properties

Compound Name2,5-dichloro-N-(4-sulfamoylphenyl)benzamide
PubChem CID669678
Molecular FormulaC13H10Cl2N2O3S
Molecular Weight345.21 g/mol
Exact Mass343.98
IUPAC Name2,5-dichloro-N-(4-sulfamoylphenyl)benzamide
SMILESNS(=O)(=O)c1ccc(NC(=O)c2cc(Cl)ccc2Cl)cc1
InChIInChI=1S/C13H10Cl2N2O3S/c14-8-1-6-12(15)11(7-8)13(18)17-9-2-4-10(5-3-9)21(16,19)20/h1-7H,(H,17,18)(H2,16,19,20)
InChIKeyRSVJZQGBMDWJAE-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 2,5-dichloro-N-(4-sulfamoylphenyl)benzamide?
The IUPAC name of 2,5-dichloro-N-(4-sulfamoylphenyl)benzamide (CID 669678) is 2,5-dichloro-N-(4-sulfamoylphenyl)benzamide.
What is the SMILES notation for 2,5-dichloro-N-(4-sulfamoylphenyl)benzamide?
The canonical SMILES for 2,5-dichloro-N-(4-sulfamoylphenyl)benzamide is NS(=O)(=O)c1ccc(NC(=O)c2cc(Cl)ccc2Cl)cc1.
What is the InChIKey of 2,5-dichloro-N-(4-sulfamoylphenyl)benzamide?
The InChIKey is RSVJZQGBMDWJAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10Cl2N2O3S/c14-8-1-6-12(15)11(7-8)13(18)17-9-2-4-10(5-3-9)21(16,19)20/h1-7H,(H,17,18)(H2,16,19,20).
What are the key properties of 2,5-dichloro-N-(4-sulfamoylphenyl)benzamide?
2,5-dichloro-N-(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 2,5-dichloro-N-(4-sulfamoylphenyl)benzamide is sourced from PubChem (CID 669678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).