4-(3,4-Dimethoxypyrrolidine-1-sulfonyl)benzene-1-sulfonamide
Basic information
- CAS
55619-43-7- Standard SMILES
COC1CN(S(=O)(=O)c2ccc(S(N)(=O)=O)cc2)CC1OC- InChIKey
VGHMSKCXHSULIZ-UHFFFAOYSA-N- Molecular formula
- C12H18N2O6S2
- Average molar mass
- 350.4 g/mol
- Monoisotopic mass
- 350.06062865
Names & identifiers
- Preferred name
- 4-(3,4-Dimethoxypyrrolidine-1-sulfonyl)benzene-1-sulfonamide
- IUPAC
- 4-(3,4-dimethoxypyrrolidin-1-yl)sulfonylbenzenesulfonamide
Names & synonyms
55619-43-74-((3,4-Dimethoxypyrrolidin-1-yl)sulfonyl)benzenesulfonamideDTXSID607875674-(3,4-Dimethoxypyrrolidine-1-sulfonyl)benzene-1-sulfonamide
Database identifiers
- CAS
55619-43-7- PubChem CID
- 71364071
- DTXSID
DTXSID60787567
Properties
Computed structural properties
- XLogP
- -0.8
- Topological polar surface area
- 133 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 560
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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