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N-(5-chloropyridin-2-yl)-4-methoxybenzenesulfonamide

HCID 759583
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Basic information

CAS
333442-20-9
Standard SMILES
COc1ccc(S(=O)(=O)Nc2ccc(Cl)cn2)cc1
InChIKey
OSFSOFLPGRISHG-UHFFFAOYSA-N
Molecular formula
C12H11ClN2O3S
Average molar mass
298.75 g/mol
Monoisotopic mass
298.0178911

Names & identifiers

Preferred name
N-(5-chloropyridin-2-yl)-4-methoxybenzenesulfonamide
IUPAC
N-(5-chloro-2-pyridinyl)-4-methoxybenzenesulfonamide

Names & synonyms

N-(5-chloropyridin-2-yl)-4-methoxybenzenesulfonamide333442-20-9N-(5-CHLOROPYRIDIN-2-YL)-4-METHOXYBENZENE-1-SULFONAMIDEOprea1_556013Oprea1_577830MLS001208041CHEMBL1881689N-(5-Chloro-pyridin-2-yl)-4-methoxy-benzenesulfonamideDTXSID201332923AKOS000644237SMR000517185ST50719050
Show more names
SR-01000435002SR-01000435002-1(5-chloro(2-pyridyl))[(4-methoxyphenyl)sulfonyl]amineF0914-2191

Database identifiers

CAS
333442-20-9
PubChem CID
759583
DTXSID
DTXSID201332923
ChEMBL
CHEMBL1881689

Properties

Computed structural properties

XLogP
2.5
Topological polar surface area
76.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
4
Heavy atoms
19
Formal charge
0
Complexity
377

Experimental & physicochemical properties

Solubility14.4 [ug/mL] (The mean of the results at pH 7.4)

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