4-[3-(3-fluorophenyl)-2-oxo-1,3-oxazol-4-yl]benzenesulfonamide

C15H11FN2O4S — CID 67676277

IUPAC4-[3-(3-fluorophenyl)-2-oxo-1,3-oxazol-4-yl]benzenesulfonamide
SMILESNS(=O)(=O)c1ccc(-c2coc(=O)n2-c2cccc(F)c2)cc1
InChIInChI=1S/C15H11FN2O4S/c16-11-2-1-3-12(8-11)18-14(9-22-15(18)19)10-4-6-13(7-5-10)23(17,20)21/h1-9H,(H2,17,20,21)
InChIKeySGLUOHCBAYJRCF-UHFFFAOYSA-N
MW334.33 g/mol
LogP1.88
Rot. Bonds3

About 4-[3-(3-fluorophenyl)-2-oxo-1,3-oxazol-4-yl]benzenesulfonamide

4-[3-(3-fluorophenyl)-2-oxo-1,3-oxazol-4-yl]benzenesulfonamide (PubChem CID 67676277) has the molecular formula C15H11FN2O4S and a molecular weight of 334.33 g/mol. Its IUPAC name is 4-[3-(3-fluorophenyl)-2-oxo-1,3-oxazol-4-yl]benzenesulfonamide.

Molecular Properties

Compound Name4-[3-(3-fluorophenyl)-2-oxo-1,3-oxazol-4-yl]benzenesulfonamide
PubChem CID67676277
Molecular FormulaC15H11FN2O4S
Molecular Weight334.33 g/mol
Exact Mass334.04
IUPAC Name4-[3-(3-fluorophenyl)-2-oxo-1,3-oxazol-4-yl]benzenesulfonamide
SMILESNS(=O)(=O)c1ccc(-c2coc(=O)n2-c2cccc(F)c2)cc1
InChIInChI=1S/C15H11FN2O4S/c16-11-2-1-3-12(8-11)18-14(9-22-15(18)19)10-4-6-13(7-5-10)23(17,20)21/h1-9H,(H2,17,20,21)
InChIKeySGLUOHCBAYJRCF-UHFFFAOYSA-N
XLogP1.88
TPSA95.30 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.33
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-[3-(3-fluorophenyl)-2-oxo-1,3-oxazol-4-yl]benzenesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-[3-(3-fluorophenyl)-2-oxo-1,3-oxazol-4-yl]benzenesulfonamide?
The IUPAC name of 4-[3-(3-fluorophenyl)-2-oxo-1,3-oxazol-4-yl]benzenesulfonamide (CID 67676277) is 4-[3-(3-fluorophenyl)-2-oxo-1,3-oxazol-4-yl]benzenesulfonamide.
What is the SMILES notation for 4-[3-(3-fluorophenyl)-2-oxo-1,3-oxazol-4-yl]benzenesulfonamide?
The canonical SMILES for 4-[3-(3-fluorophenyl)-2-oxo-1,3-oxazol-4-yl]benzenesulfonamide is NS(=O)(=O)c1ccc(-c2coc(=O)n2-c2cccc(F)c2)cc1.
What is the InChIKey of 4-[3-(3-fluorophenyl)-2-oxo-1,3-oxazol-4-yl]benzenesulfonamide?
The InChIKey is SGLUOHCBAYJRCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11FN2O4S/c16-11-2-1-3-12(8-11)18-14(9-22-15(18)19)10-4-6-13(7-5-10)23(17,20)21/h1-9H,(H2,17,20,21).
What are the key properties of 4-[3-(3-fluorophenyl)-2-oxo-1,3-oxazol-4-yl]benzenesulfonamide?
4-[3-(3-fluorophenyl)-2-oxo-1,3-oxazol-4-yl]benzenesulfonamide has a molecular weight of 334.33 g/mol, XLogP of 1.88, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(3-fluorophenyl)-2-oxo-1,3-oxazol-4-yl]benzenesulfonamide is sourced from PubChem (CID 67676277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).