Basic information
- Standard SMILES
Cn1cc(C(=O)Nc2cc(F)c(CC(=O)O)cc2Cl)c2c(F)cccc21- InChIKey
XKMJVXQUIMAIKK-UHFFFAOYSA-N- Molecular formula
- C18H13ClF2N2O3
- Average molar mass
- 378.8 g/mol
- Monoisotopic mass
- 378.0582763
Names & identifiers
- Preferred name
- (5-Chloro-2-fluoro-4-((4-fluoro-1-methyl-3-indolylcarbonyl)amino)phenyl)acetic acid
- IUPAC
- 2-[5-chloro-2-fluoro-4-[(4-fluoro-1-methylindole-3-carbonyl)amino]phenyl]acetic acid
Names & synonyms
SCHEMBL2432198XKMJVXQUIMAIKK-UHFFFAOYSA-N(5-chloro-2-fluoro-4-((4-fluoro-1-methyl-3-indolylcarbonyl)amino)phenyl)acetic acid
Database identifiers
- PubChem CID
- 17858941
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 71.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 553
Related reactions
2 records
Compound notes
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