N-(2,6-difluorophenyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
Basic information
- CAS
675826-82-1- Standard SMILES
O=S(=O)(Nc1c(F)cccc1F)c1ccc2c(c1)OCCO2- InChIKey
WQCBLIFJWOQPCI-UHFFFAOYSA-N- Molecular formula
- C14H11F2NO4S
- Average molar mass
- 327.3 g/mol
- Monoisotopic mass
- 327.03768533
Names & identifiers
- Preferred name
- N-(2,6-difluorophenyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
- IUPAC
- N-(2,6-difluorophenyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
Names & synonyms
N-(2,6-difluorophenyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide675826-82-1BAS 07783736MLS001217195CHEMBL1361728DTXSID901327278HMS1806D18HMS2902F06CCG-62501STL1937272,3-Dihydro-benzo[1,4]dioxine-6-sulfonic acid (2,6-difluoro-phenyl)-amideAKOS000951139
Show more names
NCGC00102212-01SMR000612660ST061755Z45684175(2H,3H-benzo[3,4-e]1,4-dioxan-6-ylsulfonyl)(2,6-difluorophenyl)amine
Database identifiers
- CAS
675826-82-1- PubChem CID
- 956437
- DTXSID
DTXSID901327278- ChEMBL
CHEMBL1361728
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 73 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 474
Experimental & physicochemical properties
Solubility2.5 [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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