Basic information
- Standard SMILES
COCC(C)(C)c1noc(C2CC(c3ccc(C(F)(F)F)cc3)CN(C(=O)N3CCC(C#N)CC3)C2)n1- InChIKey
XOZALJVBHQLLKM-UHFFFAOYSA-N- Molecular formula
- C26H32F3N5O3
- Average molar mass
- 519.6 g/mol
Names & identifiers
- Preferred name
- 1-({3-[3-(1-Methoxy-2-methylpropan-2-yl)-1,2,4-oxadiazol-5-yl]-5-[4-(trifluoromethyl)phenyl]-piperidin-1-yl}carbonyl)piperidine-4-carbonitrile
- IUPAC
- 1-[3-[3-(1-methoxy-2-methylpropan-2-yl)-1,2,4-oxadiazol-5-yl]-5-[4-(trifluoromethyl)phenyl]piperidine-1-carbonyl]piperidine-4-carbonitrile
Names & synonyms
1-({3-[3-(1-Methoxy-2-methylpropan-2-yl)-1,2,4-oxadiazol-5-yl]-5-[4-(trifluoromethyl)phenyl]-piperidin-1-yl}carbonyl)piperidine-4-carbonitrileSCHEMBL640786
Database identifiers
- PubChem CID
- 58002145
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 95.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 5
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 831
Related reactions
1 records
Compound notes
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