Basic information
- Standard SMILES
O=C(O)Cc1ccc(OCc2ccc3ccccc3n2)c(Cl)c1- InChIKey
MABZAWDUGLUCIU-UHFFFAOYSA-N- Molecular formula
- C18H14ClNO3
- Average molar mass
- 327.8 g/mol
- Monoisotopic mass
- 327.066221
Names & identifiers
- Preferred name
- 2-(3-Chloro-4-(quinolin-2-ylmethoxy)phenyl)acetic acid
- IUPAC
- 2-[3-chloro-4-(quinolin-2-ylmethoxy)phenyl]acetic acid
Names & synonyms
SCHEMBL1558239MABZAWDUGLUCIU-UHFFFAOYSA-N2-(3-chloro-4-(quinolin-2-ylmethoxy)phenyl)acetic acid
Database identifiers
- PubChem CID
- 19087774
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
3 records
Compound notes
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