Basic information
- Standard SMILES
CC(C)Oc1ccc(N2CCCCC2)c2sc(NC(=O)c3ccc(F)cc3)nc12- InChIKey
AZSUSWALQOTJOP-UHFFFAOYSA-N- Molecular formula
- C22H24FN3O2S
- Average molar mass
- 413.5 g/mol
Names & identifiers
- Preferred name
- 4-Fluoro-N-(4-isopropoxy-7-piperidin-1-yl-benzothiazol-2-yl)-benzamide
- IUPAC
- 4-fluoro-N-(7-piperidin-1-yl-4-propan-2-yloxy-1,3-benzothiazol-2-yl)benzamide
Names & synonyms
SCHEMBL3047926AZSUSWALQOTJOP-UHFFFAOYSA-N4-Fluoro-N-(4-isopropoxy-7-piperidin-1-yl-benzothiazol-2-yl)-benzamide
Database identifiers
- PubChem CID
- 22283383
Properties
Computed structural properties
- XLogP
- 5.4
- Topological polar surface area
- 82.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 552
Related reactions
4 records
Compound notes
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