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Basic information
- Standard SMILES
CCOC(=O)c1ncc(Cc2ccc(F)cc2)cc1NCCCN1C(=O)c2ccccc2C1=O- InChIKey
YZGMGBHVUNGJIV-UHFFFAOYSA-N- Molecular formula
- C26H24FN3O4
- Average molar mass
- 461.5 g/mol
Names & identifiers
- Preferred name
- Ethyl 3-{[3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propyl]amino}-5-[(4-fluorophenyl)methyl]-2-pyridinecarboxylate
- IUPAC
- ethyl 3-[3-(1,3-dioxoisoindol-2-yl)propylamino]-5-[(4-fluorophenyl)methyl]pyridine-2-carboxylate
Names & synonyms
SCHEMBL5545570YZGMGBHVUNGJIV-UHFFFAOYSA-NEthyl 3-{[3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propyl]amino}-5-[(4-fluorophenyl)methyl]-2-pyridinecarboxylate
Database identifiers
- PubChem CID
- 69482136
Properties
Computed structural propertiesFilling in
- XLogP
- 5
- Topological polar surface area
- 88.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 10
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 703
Related reactions
1 records
Compound notes
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