Basic information
- Standard SMILES
O=C(O)Cc1ccc(OCc2ccc3ccccc3n2)c(Br)c1- InChIKey
HDIRRVXTJSWEBG-UHFFFAOYSA-N- Molecular formula
- C18H14BrNO3
- Average molar mass
- 372.2 g/mol
Names & identifiers
- Preferred name
- 2-[3-Bromo-4-(quinolin-2-yl-methoxy)phenyl]acetic acid
- IUPAC
- 2-[3-bromo-4-(quinolin-2-ylmethoxy)phenyl]acetic acid
Names & synonyms
SCHEMBL9034967HDIRRVXTJSWEBG-UHFFFAOYSA-N2-[3-Bromo-4-(quinolin-2-yl-methoxy)phenyl]acetic acid
Database identifiers
- PubChem CID
- 19087785
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 59.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 406
Related reactions
2 records
Compound notes
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