Basic information
- Standard SMILES
Cc1cc(C(C)N2Cc3c(ccnc3C(=O)Oc3ccccc3)C2=O)cnc1OCC(F)(F)F- InChIKey
HJKIDYGACAEOCP-UHFFFAOYSA-N- Molecular formula
- C24H20F3N3O4
- Average molar mass
- 471.4 g/mol
Names & identifiers
- Preferred name
- phenyl 2-(1-(5-methyl-6-(2,2,2-trifluoroethoxy)pyridin-3-yl)ethyl)-1-oxo-2,3-dihydro-1H-pyrrolo[3,4-c]pyridine-4-carboxylate
- IUPAC
- phenyl 2-[1-[5-methyl-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]ethyl]-1-oxo-3H-pyrrolo[3,4-c]pyridine-4-carboxylate
Names & synonyms
phenyl 2-(1-(5-methyl-6-(2,2,2-trifluoroethoxy)pyridin-3-yl)ethyl)-1-oxo-2,3-dihydro-1H-pyrrolo[3,4-c]pyridine-4-carboxylateSCHEMBL15351779
Database identifiers
- PubChem CID
- 89875412
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 81.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 7
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 731
Related reactions
2 records
Compound notes
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