7-[3-(2-Furyl)phenoxy]-2,3-dihydro-1H-pyrrolo[2,1-c][1,2,4]benzothiadiazine 5,5-dioxide
Basic information
- Standard SMILES
O=S1(=O)N=C2CCCN2c2ccc(Oc3cccc(-c4ccco4)c3)cc21- InChIKey
RBXGJOFWJUWUDH-UHFFFAOYSA-N- Molecular formula
- C20H16N2O4S
- Average molar mass
- 380.4 g/mol
- Monoisotopic mass
- 380.08307817
Names & identifiers
- Preferred name
- 7-[3-(2-Furyl)phenoxy]-2,3-dihydro-1H-pyrrolo[2,1-c][1,2,4]benzothiadiazine 5,5-dioxide
- IUPAC
- 7-[3-(furan-2-yl)phenoxy]-2,3-dihydro-1H-pyrrolo[2,1-c][1,2,4]benzothiadiazine 5,5-dioxide
Names & synonyms
SCHEMBL5353168RBXGJOFWJUWUDH-UHFFFAOYSA-N7-[3-(2-Furyl)phenoxy]-2,3-dihydro-1H-pyrrolo[2,1-c][1,2,4]benzothiadiazine 5,5-dioxide
Database identifiers
- PubChem CID
- 69414643
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 80.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 689
Related reactions
2 records
Compound notes
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