Basic information
- Standard SMILES
N=C1c2c(F)cccc2S(=O)(=O)N1CC1CC1- InChIKey
SOCNPDLUOQUBHR-UHFFFAOYSA-N- Molecular formula
- C11H11FN2O2S
- Average molar mass
- 254.28 g/mol
Names & identifiers
- Preferred name
- 4-fluoro-2-cyclopropylmethyl-1,2-benzisothiazol-3(2H)-imine 1,1-dioxide
- IUPAC
- 2-(cyclopropylmethyl)-4-fluoro-1,1-dioxo-1,2-benzothiazol-3-imine
Names & synonyms
SCHEMBL2454239SOCNPDLUOQUBHR-UHFFFAOYSA-N4-fluoro-2-cyclopropylmethyl-1,2-benzisothiazol-3(2H)-imine 1,1-dioxide
Database identifiers
- PubChem CID
- 67414830
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 69.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 441
Related reactions
1 records
Compound notes
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