Basic information
- CAS
332020-73-2- Standard SMILES
O=S(=O)(NCc1ccco1)c1ccc(Cl)cc1Cl- InChIKey
XOCRSULUCSWBKK-UHFFFAOYSA-N- Molecular formula
- C11H9Cl2NO3S
- Average molar mass
- 306.2 g/mol
- Monoisotopic mass
- 304.9680197
Names & identifiers
- Preferred name
- 2,4-dichloro-N-(furan-2-ylmethyl)benzenesulfonamide
- IUPAC
- 2,4-dichloro-N-(furan-2-ylmethyl)benzenesulfonamide
Names & synonyms
2,4-dichloro-N-(furan-2-ylmethyl)benzenesulfonamide332020-73-2F0376-0004CBMicro_0335662,4-Dichloro-N-furan-2-ylmethyl-benzenesulfonamideMLS001217560CHEMBL1577015DTXSID001333018HMS2892D06SMSSF-0049981AKOS000595282UPCMLD0ENAT5955309:001
Show more names
SMR000608169BIM-0033375.P001ST50779046[(2,4-dichlorophenyl)sulfonyl](2-furylmethyl)amineZ2837271122,4-dichloro-N-[(furan-2-yl)methyl]benzene-1-sulfonamide2,4-dichlorophenyl(furfurylamino)(oxo)-lambda-sulfaniumolate
Database identifiers
- CAS
332020-73-2- PubChem CID
- 786016
- DTXSID
DTXSID001333018- ChEMBL
CHEMBL1577015
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 67.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 371
Experimental & physicochemical properties
Solubility35 [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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