Basic information
- CAS
1225536-57-1- Standard SMILES
CCc1cccc2c1NC(=O)NS2(=O)=O- InChIKey
WIMATIUPYOYOSB-UHFFFAOYSA-N- Molecular formula
- C9H10N2O3S
- Average molar mass
- 226.25 g/mol
- Monoisotopic mass
- 226.04121336
Names & identifiers
- Preferred name
- 5-ethyl-3,4-dihydro-2H-1lambda6,2,4-benzothiadiazine-1,1,3-trione
- IUPAC
- 5-ethyl-1,1-dioxo-4H-1λ6,2,4-benzothiadiazin-3-one
Names & synonyms
1225536-57-15-ethyl-3,4-dihydro-2H-1lambda6,2,4-benzothiadiazine-1,1,3-trioneEN300-9443653
Database identifiers
- CAS
1225536-57-1- PubChem CID
- 82080974
- EC Number
- 885-086-5
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 83.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 360
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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