Basic information
- Standard SMILES
COC(=O)Cc1ccc(OCc2ccc3ccccc3n2)c(Br)c1- InChIKey
OYIVHTJFEZGGBT-UHFFFAOYSA-N- Molecular formula
- C19H16BrNO3
- Average molar mass
- 386.2 g/mol
Names & identifiers
- Preferred name
- Methyl 2-[3-bromo-4-(quinolin-2-yl-methoxy)phenyl]acetate
- IUPAC
- methyl 2-[3-bromo-4-(quinolin-2-ylmethoxy)phenyl]acetate
Names & synonyms
SCHEMBL9430547OYIVHTJFEZGGBT-UHFFFAOYSA-NMethyl 2-[3-bromo-4-(quinolin-2-yl-methoxy)phenyl]acetate
Database identifiers
- PubChem CID
- 19087791
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 48.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 419
Related reactions
2 records
Compound notes
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