4-methoxy-N-(5-methyl-1,2-oxazol-3-yl)benzenesulfonamide
Basic information
- CAS
349622-20-4- Standard SMILES
COc1ccc(S(=O)(=O)Nc2cc(C)on2)cc1- InChIKey
CCMRXFMKAIPKGT-UHFFFAOYSA-N- Molecular formula
- C11H12N2O4S
- Average molar mass
- 268.29 g/mol
- Monoisotopic mass
- 268.05177804
Names & identifiers
- Preferred name
- 4-methoxy-N-(5-methyl-1,2-oxazol-3-yl)benzenesulfonamide
- IUPAC
- 4-methoxy-N-(5-methyl-1,2-oxazol-3-yl)benzenesulfonamide
Names & synonyms
4-methoxy-N-(5-methyl-1,2-oxazol-3-yl)benzenesulfonamideZINC68374349622-20-44-methoxy-N-(5-methyl-1,2-oxazol-3-yl)benzene-1-sulfonamideCambridge id 6591318Oprea1_099551Oprea1_770669MLS0012253224-Methoxy-N-(5-methyl-isoxazol-3-yl)-benzenesulfonamideCHEMBL1880963DTXSID001322033HMS2903G13
Show more names
MFCD02736076STK098150AKOS000646877COc1ccc(cc1)S(=O)(=O)Nc1noc(c1)CSMR000611554ZINC000000068374ST50302684AB00682622-01
Database identifiers
- CAS
349622-20-4- PubChem CID
- 694829
- DTXSID
DTXSID001322033- ChEMBL
CHEMBL1880963
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 89.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 360
Experimental & physicochemical properties
Solubility36.1 [ug/mL] (The mean of the results at pH 7.4)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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