N-(4-fluorophenyl)-N'-(4-sulfamoylphenyl)oxamide

C14H12FN3O4S — CID 108508654

IUPACN-(4-fluorophenyl)-N'-(4-sulfamoylphenyl)oxamide
SMILESNS(=O)(=O)c1ccc(NC(=O)C(=O)Nc2ccc(F)cc2)cc1
InChIInChI=1S/C14H12FN3O4S/c15-9-1-3-10(4-2-9)17-13(19)14(20)18-11-5-7-12(8-6-11)23(16,21)22/h1-8H,(H,17,19)(H,18,20)(H2,16,21,22)
InChIKeyDIWXWPAPORBNCH-UHFFFAOYSA-N
MW337.33 g/mol
LogP1.05
Rot. Bonds3

About N-(4-fluorophenyl)-N'-(4-sulfamoylphenyl)oxamide

N-(4-fluorophenyl)-N'-(4-sulfamoylphenyl)oxamide (PubChem CID 108508654) has the molecular formula C14H12FN3O4S and a molecular weight of 337.33 g/mol. Its IUPAC name is N-(4-fluorophenyl)-N'-(4-sulfamoylphenyl)oxamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)-N'-(4-sulfamoylphenyl)oxamide
PubChem CID108508654
Molecular FormulaC14H12FN3O4S
Molecular Weight337.33 g/mol
Exact Mass337.05
IUPAC NameN-(4-fluorophenyl)-N'-(4-sulfamoylphenyl)oxamide
SMILESNS(=O)(=O)c1ccc(NC(=O)C(=O)Nc2ccc(F)cc2)cc1
InChIInChI=1S/C14H12FN3O4S/c15-9-1-3-10(4-2-9)17-13(19)14(20)18-11-5-7-12(8-6-11)23(16,21)22/h1-8H,(H,17,19)(H,18,20)(H2,16,21,22)
InChIKeyDIWXWPAPORBNCH-UHFFFAOYSA-N
XLogP1.05
TPSA118.36 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.33
LogP ≤ 51.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

(Z)-2-cyano-3-(4-fluoroanilino)-N-(4-sulfamoylphenyl)prop-2-enamide
CID 108841821
(2R)-2-[(4-fluorophenyl)sulfonylamino]-N-(4-sulfamoylphenyl)propanamide
CID 124549106
2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxo-N-(4-sulfamoylphenyl)acetamide
CID 108508662
4-fluorobenzenesulfonamide;hydroiodide
CID 175106101
4-(4-fluorophenyl)-4-oxo-N-(4-sulfamoylphenyl)butanamide
CID 4850003
N-(2-hydroxyethyl)-N'-(4-sulfamoylphenyl)oxamide
CID 108508767
N-(4-fluorophenyl)-2-[(4-sulfamoylphenyl)methylamino]acetamide
CID 17066843
2,2,3,3,3-pentafluoro-N-(4-sulfamoylphenyl)propanamide
CID 91742405
N-[4-(diethylamino)phenyl]-N'-(4-sulfamoylphenyl)oxamide
CID 108508799
N'-(2,6-dimethylphenyl)-N-(4-sulfamoylphenyl)oxamide
CID 108508841
3-(4-fluorophenyl)-N-(4-sulfamoylphenyl)-1H-pyrazole-5-carboxamide
CID 45030518
(2R)-2-(4-fluorophenyl)sulfanyl-N-(4-sulfamoylphenyl)propanamide
CID 2639557

Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-N'-(4-sulfamoylphenyl)oxamide?
The IUPAC name of N-(4-fluorophenyl)-N'-(4-sulfamoylphenyl)oxamide (CID 108508654) is N-(4-fluorophenyl)-N'-(4-sulfamoylphenyl)oxamide.
What is the SMILES notation for N-(4-fluorophenyl)-N'-(4-sulfamoylphenyl)oxamide?
The canonical SMILES for N-(4-fluorophenyl)-N'-(4-sulfamoylphenyl)oxamide is NS(=O)(=O)c1ccc(NC(=O)C(=O)Nc2ccc(F)cc2)cc1.
What is the InChIKey of N-(4-fluorophenyl)-N'-(4-sulfamoylphenyl)oxamide?
The InChIKey is DIWXWPAPORBNCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12FN3O4S/c15-9-1-3-10(4-2-9)17-13(19)14(20)18-11-5-7-12(8-6-11)23(16,21)22/h1-8H,(H,17,19)(H,18,20)(H2,16,21,22).
What are the key properties of N-(4-fluorophenyl)-N'-(4-sulfamoylphenyl)oxamide?
N-(4-fluorophenyl)-N'-(4-sulfamoylphenyl)oxamide has a molecular weight of 337.33 g/mol, XLogP of 1.05, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-N'-(4-sulfamoylphenyl)oxamide is sourced from PubChem (CID 108508654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).