N-2,1-benzisoxazol-3-yl-4-(3-{[5-(trifluoromethyl)pyridin-2-yl]oxy}benzylidene)piperidine-1-carboxamide
Basic information
- Standard SMILES
O=C(Nc1onc2ccccc12)N1CCC(=Cc2cccc(Oc3ccc(C(F)(F)F)cn3)c2)CC1- InChIKey
OXIMOQPJERHNBW-UHFFFAOYSA-N- Molecular formula
- C26H21F3N4O3
- Average molar mass
- 494.5 g/mol
Names & identifiers
- Preferred name
- N-2,1-benzisoxazol-3-yl-4-(3-{[5-(trifluoromethyl)pyridin-2-yl]oxy}benzylidene)piperidine-1-carboxamide
- IUPAC
- N-(2,1-benzoxazol-3-yl)-4-[[3-[[5-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]methylidene]piperidine-1-carboxamide
Names & synonyms
N-2,1-benzisoxazol-3-yl-4-(3-{[5-(trifluoromethyl)pyridin-2-yl]oxy}benzylidene)piperidine-1-carboxamideSCHEMBL1011615
Database identifiers
- PubChem CID
- 24967992
Properties
Computed structural properties
- XLogP
- 5.2
- Topological polar surface area
- 80.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 4
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 785
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
1 records
Compound notes
Loading…