Basic information
- Standard SMILES
COc1ccc(Cc2ccc(C(C)N)nc2)c(F)c1-c1cccc(Cl)c1- InChIKey
LZDWUWDXXMCKTL-UHFFFAOYSA-N- Molecular formula
- C21H20ClFN2O
- Average molar mass
- 370.8 g/mol
Names & identifiers
- Preferred name
- 1-[5-(3'-Chloro-2-fluoro-6-methoxy-biphenyl-3-ylmethyl)-pyridin-2-yl]-ethylamine
- IUPAC
- 1-[5-[[3-(3-chlorophenyl)-2-fluoro-4-methoxyphenyl]methyl]-2-pyridinyl]ethanamine
Names & synonyms
SCHEMBL4319349LZDWUWDXXMCKTL-UHFFFAOYSA-N1-[5-(3'-Chloro-2-fluoro-6-methoxy-biphenyl-3-ylmethyl)-pyridin-2-yl]-ethylamine
Database identifiers
- PubChem CID
- 58019987
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 48.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 440
Related reactions
2 records
Compound notes
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