N'-(5-chloro-2-hydroxyphenyl)-N-(4-sulfamoylphenyl)oxamide

C14H12ClN3O5S — CID 108508697

IUPACN'-(5-chloro-2-hydroxyphenyl)-N-(4-sulfamoylphenyl)oxamide
SMILESNS(=O)(=O)c1ccc(NC(=O)C(=O)Nc2cc(Cl)ccc2O)cc1
InChIInChI=1S/C14H12ClN3O5S/c15-8-1-6-12(19)11(7-8)18-14(21)13(20)17-9-2-4-10(5-3-9)24(16,22)23/h1-7,19H,(H,17,20)(H,18,21)(H2,16,22,23)
InChIKeyAFQZBGMUNOPQEA-UHFFFAOYSA-N
MW369.79 g/mol
LogP1.27
Rot. Bonds3

About N'-(5-chloro-2-hydroxyphenyl)-N-(4-sulfamoylphenyl)oxamide

N'-(5-chloro-2-hydroxyphenyl)-N-(4-sulfamoylphenyl)oxamide (PubChem CID 108508697) has the molecular formula C14H12ClN3O5S and a molecular weight of 369.79 g/mol. Its IUPAC name is N'-(5-chloro-2-hydroxyphenyl)-N-(4-sulfamoylphenyl)oxamide.

Molecular Properties

Compound NameN'-(5-chloro-2-hydroxyphenyl)-N-(4-sulfamoylphenyl)oxamide
PubChem CID108508697
Molecular FormulaC14H12ClN3O5S
Molecular Weight369.79 g/mol
Exact Mass369.02
IUPAC NameN'-(5-chloro-2-hydroxyphenyl)-N-(4-sulfamoylphenyl)oxamide
SMILESNS(=O)(=O)c1ccc(NC(=O)C(=O)Nc2cc(Cl)ccc2O)cc1
InChIInChI=1S/C14H12ClN3O5S/c15-8-1-6-12(19)11(7-8)18-14(21)13(20)17-9-2-4-10(5-3-9)24(16,22)23/h1-7,19H,(H,17,20)(H,18,21)(H2,16,22,23)
InChIKeyAFQZBGMUNOPQEA-UHFFFAOYSA-N
XLogP1.27
TPSA138.59 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.79
LogP ≤ 51.27
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'catechol', 'substructure': 'N/A'}, {'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Related Compounds

N'-(5-chloro-2-hydroxyphenyl)-N-(4-chlorophenyl)oxamide
CID 108516598
N-(4-amino-3-chlorophenyl)-N'-(5-chloro-2-hydroxyphenyl)oxamide
CID 108515977
N'-(2-chloro-5-nitrophenyl)-N-(4-sulfamoylphenyl)oxamide
CID 108508659
N-(4-fluorophenyl)-N'-(4-sulfamoylphenyl)oxamide
CID 108508654
N-(5-chloro-2-hydroxyphenyl)-N'-(1,2,4-triazol-4-yl)oxamide
CID 108519080
N-[4-(diethylamino)phenyl]-N'-(4-sulfamoylphenyl)oxamide
CID 108508799
1-(5-chloro-2-hydroxyphenyl)-3-[4-(dimethylamino)phenyl]urea
CID 108894768
4-chloro-1-hydroxy-2-(sulfamoylamino)benzene
CID 28895885
5-chloro-2-(propanoylamino)-N-(4-sulfamoylphenyl)benzamide
CID 10362460
N'-(3,5-dichloro-2-hydroxyphenyl)-N-(5-ethylsulfonyl-2-hydroxyphenyl)oxamide
CID 11750845
N'-(4-aminobenzoyl)-N-(5-chloro-2-hydroxyphenyl)oxamide
CID 108519760
1-(5-chloro-2-hydroxyphenyl)-3-(4-chlorophenyl)thiourea
CID 87655959

Frequently Asked Questions

What is the IUPAC name of N'-(5-chloro-2-hydroxyphenyl)-N-(4-sulfamoylphenyl)oxamide?
The IUPAC name of N'-(5-chloro-2-hydroxyphenyl)-N-(4-sulfamoylphenyl)oxamide (CID 108508697) is N'-(5-chloro-2-hydroxyphenyl)-N-(4-sulfamoylphenyl)oxamide.
What is the SMILES notation for N'-(5-chloro-2-hydroxyphenyl)-N-(4-sulfamoylphenyl)oxamide?
The canonical SMILES for N'-(5-chloro-2-hydroxyphenyl)-N-(4-sulfamoylphenyl)oxamide is NS(=O)(=O)c1ccc(NC(=O)C(=O)Nc2cc(Cl)ccc2O)cc1.
What is the InChIKey of N'-(5-chloro-2-hydroxyphenyl)-N-(4-sulfamoylphenyl)oxamide?
The InChIKey is AFQZBGMUNOPQEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12ClN3O5S/c15-8-1-6-12(19)11(7-8)18-14(21)13(20)17-9-2-4-10(5-3-9)24(16,22)23/h1-7,19H,(H,17,20)(H,18,21)(H2,16,22,23).
What are the key properties of N'-(5-chloro-2-hydroxyphenyl)-N-(4-sulfamoylphenyl)oxamide?
N'-(5-chloro-2-hydroxyphenyl)-N-(4-sulfamoylphenyl)oxamide has a molecular weight of 369.79 g/mol, XLogP of 1.27, 3 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(5-chloro-2-hydroxyphenyl)-N-(4-sulfamoylphenyl)oxamide is sourced from PubChem (CID 108508697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).