5-chloro-2-methyl-N-(1,2-oxazol-3-yl)benzenesulfonamide

C10H9ClN2O3S — CID 84597569

IUPAC5-chloro-2-methyl-N-(1,2-oxazol-3-yl)benzenesulfonamide
SMILESCc1ccc(Cl)cc1S(=O)(=O)Nc1ccon1
InChIInChI=1S/C10H9ClN2O3S/c1-7-2-3-8(11)6-9(7)17(14,15)13-10-4-5-16-12-10/h2-6H,1H3,(H,12,13)
InChIKeyWQIUBHGDJTVCGB-UHFFFAOYSA-N
MW272.71 g/mol
LogP2.44
Rot. Bonds3

About 5-chloro-2-methyl-N-(1,2-oxazol-3-yl)benzenesulfonamide

5-chloro-2-methyl-N-(1,2-oxazol-3-yl)benzenesulfonamide (PubChem CID 84597569) has the molecular formula C10H9ClN2O3S and a molecular weight of 272.71 g/mol. Its IUPAC name is 5-chloro-2-methyl-N-(1,2-oxazol-3-yl)benzenesulfonamide.

Molecular Properties

Compound Name5-chloro-2-methyl-N-(1,2-oxazol-3-yl)benzenesulfonamide
PubChem CID84597569
Molecular FormulaC10H9ClN2O3S
Molecular Weight272.71 g/mol
Exact Mass272.00
IUPAC Name5-chloro-2-methyl-N-(1,2-oxazol-3-yl)benzenesulfonamide
SMILESCc1ccc(Cl)cc1S(=O)(=O)Nc1ccon1
InChIInChI=1S/C10H9ClN2O3S/c1-7-2-3-8(11)6-9(7)17(14,15)13-10-4-5-16-12-10/h2-6H,1H3,(H,12,13)
InChIKeyWQIUBHGDJTVCGB-UHFFFAOYSA-N
XLogP2.44
TPSA72.20 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.71
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-chloro-2-methyl-N-(1,2-oxazol-3-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 5-chloro-2-methyl-N-(1,2-oxazol-3-yl)benzenesulfonamide?
The IUPAC name of 5-chloro-2-methyl-N-(1,2-oxazol-3-yl)benzenesulfonamide (CID 84597569) is 5-chloro-2-methyl-N-(1,2-oxazol-3-yl)benzenesulfonamide.
What is the SMILES notation for 5-chloro-2-methyl-N-(1,2-oxazol-3-yl)benzenesulfonamide?
The canonical SMILES for 5-chloro-2-methyl-N-(1,2-oxazol-3-yl)benzenesulfonamide is Cc1ccc(Cl)cc1S(=O)(=O)Nc1ccon1.
What is the InChIKey of 5-chloro-2-methyl-N-(1,2-oxazol-3-yl)benzenesulfonamide?
The InChIKey is WQIUBHGDJTVCGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9ClN2O3S/c1-7-2-3-8(11)6-9(7)17(14,15)13-10-4-5-16-12-10/h2-6H,1H3,(H,12,13).
What are the key properties of 5-chloro-2-methyl-N-(1,2-oxazol-3-yl)benzenesulfonamide?
5-chloro-2-methyl-N-(1,2-oxazol-3-yl)benzenesulfonamide has a molecular weight of 272.71 g/mol, XLogP of 2.44, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-methyl-N-(1,2-oxazol-3-yl)benzenesulfonamide is sourced from PubChem (CID 84597569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).