4-fluoro-N-(5-phenyl-1,2-oxazol-3-yl)benzenesulfonamide

C15H11FN2O3S — CID 153381040

IUPAC4-fluoro-N-(5-phenyl-1,2-oxazol-3-yl)benzenesulfonamide
SMILESO=S(=O)(Nc1cc(-c2ccccc2)on1)c1ccc(F)cc1
InChIInChI=1S/C15H11FN2O3S/c16-12-6-8-13(9-7-12)22(19,20)18-15-10-14(21-17-15)11-4-2-1-3-5-11/h1-10H,(H,17,18)
InChIKeyHCGQPWVXCATVAE-UHFFFAOYSA-N
MW318.33 g/mol
LogP3.28
Rot. Bonds4

About 4-fluoro-N-(5-phenyl-1,2-oxazol-3-yl)benzenesulfonamide

4-fluoro-N-(5-phenyl-1,2-oxazol-3-yl)benzenesulfonamide (PubChem CID 153381040) has the molecular formula C15H11FN2O3S and a molecular weight of 318.33 g/mol. Its IUPAC name is 4-fluoro-N-(5-phenyl-1,2-oxazol-3-yl)benzenesulfonamide.

Molecular Properties

Compound Name4-fluoro-N-(5-phenyl-1,2-oxazol-3-yl)benzenesulfonamide
PubChem CID153381040
Molecular FormulaC15H11FN2O3S
Molecular Weight318.33 g/mol
Exact Mass318.05
IUPAC Name4-fluoro-N-(5-phenyl-1,2-oxazol-3-yl)benzenesulfonamide
SMILESO=S(=O)(Nc1cc(-c2ccccc2)on1)c1ccc(F)cc1
InChIInChI=1S/C15H11FN2O3S/c16-12-6-8-13(9-7-12)22(19,20)18-15-10-14(21-17-15)11-4-2-1-3-5-11/h1-10H,(H,17,18)
InChIKeyHCGQPWVXCATVAE-UHFFFAOYSA-N
XLogP3.28
TPSA72.20 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.33
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-(5-phenyl-1,2-oxazol-3-yl)benzenesulfonamide?
The IUPAC name of 4-fluoro-N-(5-phenyl-1,2-oxazol-3-yl)benzenesulfonamide (CID 153381040) is 4-fluoro-N-(5-phenyl-1,2-oxazol-3-yl)benzenesulfonamide.
What is the SMILES notation for 4-fluoro-N-(5-phenyl-1,2-oxazol-3-yl)benzenesulfonamide?
The canonical SMILES for 4-fluoro-N-(5-phenyl-1,2-oxazol-3-yl)benzenesulfonamide is O=S(=O)(Nc1cc(-c2ccccc2)on1)c1ccc(F)cc1.
What is the InChIKey of 4-fluoro-N-(5-phenyl-1,2-oxazol-3-yl)benzenesulfonamide?
The InChIKey is HCGQPWVXCATVAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11FN2O3S/c16-12-6-8-13(9-7-12)22(19,20)18-15-10-14(21-17-15)11-4-2-1-3-5-11/h1-10H,(H,17,18).
What are the key properties of 4-fluoro-N-(5-phenyl-1,2-oxazol-3-yl)benzenesulfonamide?
4-fluoro-N-(5-phenyl-1,2-oxazol-3-yl)benzenesulfonamide has a molecular weight of 318.33 g/mol, XLogP of 3.28, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-(5-phenyl-1,2-oxazol-3-yl)benzenesulfonamide is sourced from PubChem (CID 153381040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).