Basic information
- Standard SMILES
Cc1nc(Cn2c(=O)sc3cc(F)c(N4C(=O)C5=C(CCCC5)C4=O)cc32)no1- InChIKey
INAHVIQWZHLJQR-UHFFFAOYSA-N- Molecular formula
- C19H15FN4O4S
- Average molar mass
- 414.4 g/mol
Names & identifiers
- Preferred name
- 6-fluoro-3-(5-methyl-1,2,4-oxadiazol-3-ylmethyl)-5-(4,5,6,7-tetrahydro-2H-isoindole-1,3-dion-2-yl)-2(3H)-benzothiazolone
- IUPAC
- 2-[6-fluoro-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-2-oxo-1,3-benzothiazol-5-yl]-4,5,6,7-tetrahydroisoindole-1,3-dione
Names & synonyms
SCHEMBL9685792INAHVIQWZHLJQR-UHFFFAOYSA-N6-fluoro-3-(5-methyl-1,2,4-oxadiazol-3-ylmethyl)-5-(4,5,6,7-tetrahydro-2H-isoindole-1,3-dion-2-yl)-2(3H)-benzothiazolone
Database identifiers
- PubChem CID
- 19979475
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 122 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 3
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 764
Related reactions
2 records
Compound notes
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