Basic information
- Standard SMILES
O=C1C2=C(CCCC2)C(=O)N1c1c(F)cc(Cl)c2nc(Cl)sc12- InChIKey
BQXNCTHUENGVME-UHFFFAOYSA-N- Molecular formula
- C15H9Cl2FN2O2S
- Average molar mass
- 371.2 g/mol
Names & identifiers
- Preferred name
- N-(2,4-Dichloro-6-fluorobenzothiazol-7-yl)-3,4,5,6-tetrahydrophthalimide
- IUPAC
- 2-(2,4-dichloro-6-fluoro-1,3-benzothiazol-7-yl)-4,5,6,7-tetrahydroisoindole-1,3-dione
Names & synonyms
SCHEMBL9144906BQXNCTHUENGVME-UHFFFAOYSA-NN-(2,4-Dichloro-6-fluorobenzothiazol-7-yl)-3,4,5,6-tetrahydrophthalimide
Database identifiers
- PubChem CID
- 19933466
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 78.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 574
Related reactions
2 records
Compound notes
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