Basic information
- Standard SMILES
COc1ccc(/C=C/C(=O)Nc2cnn(Cc3ccc(C(C)=O)o3)n2)cc1- InChIKey
RFYGOKWTXVFLBB-BJMVGYQFSA-N- Molecular formula
- C19H18N4O4
- Average molar mass
- 366.4 g/mol
Names & identifiers
- Preferred name
- (E)-N-[2-(5-Acetyl-furan-2-ylmethyl)-2H-[1,2,3]triazol-4-yl]-3-(4-methoxy-phenyl)-acrylamide
- IUPAC
- (E)-N-[2-[(5-acetylfuran-2-yl)methyl]triazol-4-yl]-3-(4-methoxyphenyl)prop-2-enamide
Names & synonyms
SCHEMBL2327017RFYGOKWTXVFLBB-BJMVGYQFSA-N(E)-N-[2-(5-Acetyl-furan-2-ylmethyl)-2H-[1,2,3]triazol-4-yl]-3-(4-methoxy-phenyl)-acrylamide
Database identifiers
- PubChem CID
- 42645552
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 99.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 548
Related reactions
1 records
Compound notes
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