Basic information
- Standard SMILES
COc1ccc(N2C(=O)Nc3ccccc3S2(=O)=O)nc1OC- InChIKey
JICIVVLNXOZLPT-UHFFFAOYSA-N- Molecular formula
- C14H13N3O5S
- Average molar mass
- 335.34 g/mol
Names & identifiers
- Preferred name
- 2-(5,6-Dimethoxypyridin-2-yl)-2H-1,2,4-benzothiadiazin-3(4H)-one 1,1-dioxide
- IUPAC
- 2-(5,6-dimethoxy-2-pyridinyl)-1,1-dioxo-4H-1λ6,2,4-benzothiadiazin-3-one
Names & synonyms
SCHEMBL15587628JICIVVLNXOZLPT-UHFFFAOYSA-N2-(5,6-Dimethoxypyridin-2-yl)-2H-1,2,4-benzothiadiazin-3(4H)-one 1,1-dioxide
Database identifiers
- PubChem CID
- 90054864
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 106 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 549
Related reactions
1 records
Compound notes
Loading…