Basic information
- Standard SMILES
CCOC(=O)Cn1c(=O)sc2cc(F)c(N)cc21- InChIKey
XDHGRGLXYSTGCS-UHFFFAOYSA-N- Molecular formula
- C11H11FN2O3S
- Average molar mass
- 270.28 g/mol
Names & identifiers
- Preferred name
- 5-amino-3-ethoxycarbonylmethyl-6-fluoro-2(3H)-benzothiazolone
- IUPAC
- ethyl 2-(5-amino-6-fluoro-2-oxo-1,3-benzothiazol-3-yl)acetate
Names & synonyms
SCHEMBL10365806XDHGRGLXYSTGCS-UHFFFAOYSA-N5-amino-3-ethoxycarbonylmethyl-6-fluoro-2(3H)-benzothiazolone5-Amino-3-ethoxycarbonylmethyl-6-fluoro-2(3H)benzothiazolone
Database identifiers
- PubChem CID
- 14014245
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 97.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 355
Related reactions
6 records
Compound notes
Loading…