Basic information
- Standard SMILES
COc1ccc(-c2ccc(=O)n(Cc3ccc(C(F)(F)F)nc3)c2)cc1.Cl- InChIKey
NCSRXJHBTSOGDA-UHFFFAOYSA-N- Molecular formula
- C19H16ClF3N2O2
- Average molar mass
- 396.8 g/mol
- Monoisotopic mass
- 396.0852399
Names & identifiers
- Preferred name
- 5-(4-methoxyphenyl)-1-((6-(trifluoromethyl)pyridin-3-yl)methyl)pyridin-2(1H)-one hydrochloride
- IUPAC
- 5-(4-methoxyphenyl)-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]pyridin-2-one;hydrochloride
Names & synonyms
5-(4-methoxyphenyl)-1-((6-(trifluoromethyl)pyridin-3-yl)methyl)pyridin-2(1H)-one hydrochlorideSCHEMBL5182960
Database identifiers
- PubChem CID
- 69344811
Properties
Computed structural properties
- Topological polar surface area
- 42.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 566
Related reactions
1 records
Compound notes
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