Basic information
- Standard SMILES
O=C(O)c1ccn2cc(Cn3ccc4c(C(=O)c5c(F)cc(F)cc5F)c[nH]c4c3=O)nc2c1- InChIKey
YTDCMMJJKDSRRA-UHFFFAOYSA-N- Molecular formula
- C23H13F3N4O4
- Average molar mass
- 466.4 g/mol
Names & identifiers
- Preferred name
- 2-{[7-oxo-3-(2,4,6-trifluorobenzoyl)-1,7-dihydro-6H-pyrrolo[2,3-c]pyridin-6-yl]methyl}imidazo[1,2-a]pyridine-7-carboxylic acid
- IUPAC
- 2-[[7-oxo-3-(2,4,6-trifluorobenzoyl)-1H-pyrrolo[2,3-c]pyridin-6-yl]methyl]imidazo[1,2-a]pyridine-7-carboxylic acid
Names & synonyms
SCHEMBL1715979YTDCMMJJKDSRRA-UHFFFAOYSA-N2-{[7-oxo-3-(2,4,6-trifluorobenzoyl)-1,7-dihydro-6H-pyrrolo[2,3-c]pyridin-6-yl]methyl}imidazo[1,2-a]pyridine-7-carboxylic acid
Database identifiers
- PubChem CID
- 44546728
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 108 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 5
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 863
Related reactions
4 records
Compound notes
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