2-[[4-(1,3-oxazol-5-yl)phenyl]sulfamoyl]acetic acid

C11H10N2O5S — CID 55025378

IUPAC2-[[4-(1,3-oxazol-5-yl)phenyl]sulfamoyl]acetic acid
SMILESO=C(O)CS(=O)(=O)Nc1ccc(-c2cnco2)cc1
InChIInChI=1S/C11H10N2O5S/c14-11(15)6-19(16,17)13-9-3-1-8(2-4-9)10-5-12-7-18-10/h1-5,7,13H,6H2,(H,14,15)
InChIKeyOSSDILSJCXRQJG-UHFFFAOYSA-N
MW282.28 g/mol
LogP1.17
Rot. Bonds5

About 2-[[4-(1,3-oxazol-5-yl)phenyl]sulfamoyl]acetic acid

2-[[4-(1,3-oxazol-5-yl)phenyl]sulfamoyl]acetic acid (PubChem CID 55025378) has the molecular formula C11H10N2O5S and a molecular weight of 282.28 g/mol. Its IUPAC name is 2-[[4-(1,3-oxazol-5-yl)phenyl]sulfamoyl]acetic acid.

Molecular Properties

Compound Name2-[[4-(1,3-oxazol-5-yl)phenyl]sulfamoyl]acetic acid
PubChem CID55025378
Molecular FormulaC11H10N2O5S
Molecular Weight282.28 g/mol
Exact Mass282.03
IUPAC Name2-[[4-(1,3-oxazol-5-yl)phenyl]sulfamoyl]acetic acid
SMILESO=C(O)CS(=O)(=O)Nc1ccc(-c2cnco2)cc1
InChIInChI=1S/C11H10N2O5S/c14-11(15)6-19(16,17)13-9-3-1-8(2-4-9)10-5-12-7-18-10/h1-5,7,13H,6H2,(H,14,15)
InChIKeyOSSDILSJCXRQJG-UHFFFAOYSA-N
XLogP1.17
TPSA109.50 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.28
LogP ≤ 51.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[[4-(1,3-oxazol-5-yl)phenyl]sulfamoyl]acetic acid?
The IUPAC name of 2-[[4-(1,3-oxazol-5-yl)phenyl]sulfamoyl]acetic acid (CID 55025378) is 2-[[4-(1,3-oxazol-5-yl)phenyl]sulfamoyl]acetic acid.
What is the SMILES notation for 2-[[4-(1,3-oxazol-5-yl)phenyl]sulfamoyl]acetic acid?
The canonical SMILES for 2-[[4-(1,3-oxazol-5-yl)phenyl]sulfamoyl]acetic acid is O=C(O)CS(=O)(=O)Nc1ccc(-c2cnco2)cc1.
What is the InChIKey of 2-[[4-(1,3-oxazol-5-yl)phenyl]sulfamoyl]acetic acid?
The InChIKey is OSSDILSJCXRQJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O5S/c14-11(15)6-19(16,17)13-9-3-1-8(2-4-9)10-5-12-7-18-10/h1-5,7,13H,6H2,(H,14,15).
What are the key properties of 2-[[4-(1,3-oxazol-5-yl)phenyl]sulfamoyl]acetic acid?
2-[[4-(1,3-oxazol-5-yl)phenyl]sulfamoyl]acetic acid has a molecular weight of 282.28 g/mol, XLogP of 1.17, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[4-(1,3-oxazol-5-yl)phenyl]sulfamoyl]acetic acid is sourced from PubChem (CID 55025378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).