4-(1,4-Oxazepane-4-sulfonyl)benzene-1-sulfonamide
Basic information
- CAS
55619-42-6- Standard SMILES
NS(=O)(=O)c1ccc(S(=O)(=O)N2CCCOCC2)cc1- InChIKey
XPFBLSPFHFDTTL-UHFFFAOYSA-N- Molecular formula
- C11H16N2O5S2
- Average molar mass
- 320.4 g/mol
- Monoisotopic mass
- 320.05006396
Names & identifiers
- Preferred name
- 4-(1,4-Oxazepane-4-sulfonyl)benzene-1-sulfonamide
- IUPAC
- 4-(1,4-oxazepan-4-ylsulfonyl)benzenesulfonamide
Names & synonyms
55619-42-64-((1,4-Oxazepan-4-yl)sulfonyl)benzenesulfonamide4-(1,4-Oxazepane-4-sulfonyl)benzene-1-sulfonamideDTXSID20787568
Database identifiers
- CAS
55619-42-6- PubChem CID
- 71364072
- DTXSID
DTXSID20787568
Properties
Computed structural properties
- XLogP
- -0.4
- Topological polar surface area
- 124 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 512
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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