Basic information
- Standard SMILES
NC(=O)c1c(F)ccc(OCc2nc3c(Cl)cccc3s2)c1F- InChIKey
DJFNHBOOMSGIHZ-UHFFFAOYSA-N- Molecular formula
- C15H9ClF2N2O2S
- Average molar mass
- 354.8 g/mol
- Monoisotopic mass
- 354.0041327
Names & identifiers
- Preferred name
- 3-[(4-Chloro-1,3-benzothiazol-2-yl)methoxy]-2,6-difluorobenzenecarboxamide
- IUPAC
- 3-[(4-chloro-1,3-benzothiazol-2-yl)methoxy]-2,6-difluorobenzamide
Names & synonyms
SCHEMBL203022CHEMBL1094221DJFNHBOOMSGIHZ-UHFFFAOYSA-N3-[(4-Chloro-1,3-benzothiazol-2-yl)methoxy]-2,6-difluorobenzenecarboxamide
Database identifiers
- PubChem CID
- 46237138
- ChEMBL
CHEMBL1094221
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 93.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 448
Related reactions
2 records
Compound notes
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