Basic information
- Standard SMILES
Cl.N[C@@H](Cc1cc(F)cc(F)c1)c1ncc(N2C(=O)c3ccccc3C2=O)cc1Br- InChIKey
IFGHWTKRNFVHNV-FERBBOLQSA-N- Molecular formula
- C21H15BrClF2N3O2
- Average molar mass
- 494.7 g/mol
Names & identifiers
- Preferred name
- (S)-2-(6-(1-amino-2-(3,5-difluorophenyl)ethyl)-5-bromopyridin-3-yl)isoindoline-1,3-dione hydrochloride
- IUPAC
- 2-[6-[(1S)-1-amino-2-(3,5-difluorophenyl)ethyl]-5-bromo-3-pyridinyl]isoindole-1,3-dione;hydrochloride
Names & synonyms
SCHEMBL15874101IFGHWTKRNFVHNV-FERBBOLQSA-N(S)-2-(6-(1-amino-2-(3,5-difluorophenyl)ethyl)-5-bromopyridin-3-yl)isoindoline-1,3-dione hydrochloride
Database identifiers
- PubChem CID
- 90280362
Properties
Computed structural properties
- Topological polar surface area
- 76.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 605
Related reactions
2 records
Compound notes
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