Basic information
- Standard SMILES
COC(=O)[C@H](Cc1ccc(-c2c(OC)ccc(F)c2OC)cc1)NC(=O)c1c(Cl)cccc1Cl- InChIKey
FADDPKMRKYOTBV-IBGZPJMESA-N- Molecular formula
- C25H22Cl2FNO5
- Average molar mass
- 506.3 g/mol
Names & identifiers
- Preferred name
- N-(2,6-dichlorobenzoyl)-4-(2,6-dimethoxy-3-fluorophenyl)-L-phenylalanine methyl ester
- IUPAC
- methyl (2S)-2-[(2,6-dichlorobenzoyl)amino]-3-[4-(3-fluoro-2,6-dimethoxyphenyl)phenyl]propanoate
Names & synonyms
SCHEMBL6497529FADDPKMRKYOTBV-IBGZPJMESA-NN-(2,6-dichlorobenzoyl)-4-(2,6-dimethoxy-3-fluorophenyl)-L-phenylalanine methyl ester
Database identifiers
- PubChem CID
- 53788482
Properties
Computed structural properties
- XLogP
- 6
- Topological polar surface area
- 73.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 668
Related reactions
2 records
Compound notes
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