Basic information
- Standard SMILES
CC(=O)c1ccc(Cn2ccc(NC(=O)/C=C/c3cccc(C(F)(F)F)c3)n2)o1- InChIKey
ZYZWCWKJYDZFOC-VMPITWQZSA-N- Molecular formula
- C20H16F3N3O3
- Average molar mass
- 403.4 g/mol
Names & identifiers
- Preferred name
- (E)-N-[1-(5-Acetyl-furan-2-ylmethyl)-1H-pyrazol-3-yl]-3-(3-trifluoromethyl-phenyl)-acrylamide
- IUPAC
- (E)-N-[1-[(5-acetylfuran-2-yl)methyl]pyrazol-3-yl]-3-[3-(trifluoromethyl)phenyl]prop-2-enamide
Names & synonyms
(E)-N-[1-(5-Acetyl-furan-2-ylmethyl)-1H-pyrazol-3-yl]-3-(3-trifluoromethyl-phenyl)-acrylamideSCHEMBL1167453
Database identifiers
- PubChem CID
- 42644641
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 77.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 626
Related reactions
1 records
Compound notes
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