Basic information
- Standard SMILES
COc1ccc2nc(-c3ccc(NC(=O)c4cccc(C(F)(F)F)c4)cc3)sc2c1- InChIKey
SLLLHSJYLSSYFJ-UHFFFAOYSA-N- Molecular formula
- C22H15F3N2O2S
- Average molar mass
- 428.4 g/mol
- Monoisotopic mass
- 428.08063339
Names & identifiers
- Preferred name
- 3-Trifluoromethyl-N-[4-(6-methoxybenzothiazol-2-yl)-phenyl]-benzamide
- IUPAC
- N-[4-(6-methoxy-1,3-benzothiazol-2-yl)phenyl]-3-(trifluoromethyl)benzamide
Names & synonyms
3-Trifluoromethyl-N-[4-(6-methoxybenzothiazol-2-yl)-phenyl]-benzamideSCHEMBL2192465
Database identifiers
- PubChem CID
- 67312136
Properties
Computed structural properties
- XLogP
- 5.7
- Topological polar surface area
- 79.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 597
Related reactions
1 records
Compound notes
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