N-formyl-3,4-dimethoxy-L-phenylalanine ethyl ester
Basic information
- Standard SMILES
CCOC(=O)[C@H](Cc1ccc(OC)c(OC)c1)NC=O- InChIKey
ATOFCVFHLSPTJI-NSHDSACASA-N- Molecular formula
- C14H19NO5
- Average molar mass
- 281.3 g/mol
- Monoisotopic mass
- 281.12632271
Names & identifiers
- Preferred name
- N-formyl-3,4-dimethoxy-L-phenylalanine ethyl ester
- IUPAC
- ethyl (2S)-3-(3,4-dimethoxyphenyl)-2-formamidopropanoate
Names & synonyms
SCHEMBL8932191ATOFCVFHLSPTJI-NSHDSACASA-NN-formyl-3,4-dimethoxy-L-phenylalanine ethyl ester
Database identifiers
- PubChem CID
- 10945877
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 73.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 310
Related reactions
6 records
Compound notes
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