LY-487379 hydrochloride
Basic information
- CAS
353229-59-1- Standard SMILES
COc1ccccc1Oc1ccc(N(Cc2cccnc2)S(=O)(=O)CC(F)(F)F)cc1.Cl- InChIKey
LPWFRDWTOKLHJC-UHFFFAOYSA-N- Molecular formula
- C21H20ClF3N2O4S
- Average molar mass
- 488.9 g/mol
- Monoisotopic mass
- 488.0784405
Names & identifiers
- Preferred name
- LY-487379 hydrochloride
- IUPAC
- 2,2,2-trifluoro-N-[4-(2-methoxyphenoxy)phenyl]-N-(pyridin-3-ylmethyl)ethanesulfonamide;hydrochloride
- English name
- EthanesulfonaMide, 2,2,2-trifluoro-N-[4-(2-Methoxyphenoxy)phenyl]-N-(3-pyridinylMethyl)-, Monohydrochloride
- Molecular formula
- C21H20ClF3N2O4S
- Molecular weight
- 488.91
Names & synonyms
353229-59-1LY-487379 hydrochlorideUQP3N7RUC32,2,2-Trifluoro-N-(4-(2-methoxyphenoxy)phenyl)-N-(pyridin-3-ylmethyl)ethanesulfonamide hydrochlorideEthanesulfonamide, 2,2,2-trifluoro-N-(4-(2-methoxyphenoxy)phenyl)-N-(3-pyridinylmethyl)-, hydrochloride (1:1)Ethanesulfonamide, 2,2,2-trifluoro-N-(4-(2-methoxyphenoxy)phenyl)-N-(3-pyridinylmethyl)-, monohydrochlorideEthanesulfonaMide, 2,2,2-trifluoro-N-[4-(2-Methoxyphenoxy)phenyl]-N-(3-pyridinylMethyl)-, MonohydrochlorideRefChem:201532LY 487379 HYDROCHLORIDELY487379 HClLY487379 hydrochlorideLY487379 (hydrochloride)
Show more names
LY-487379 hydrochloride,LY487379 hydrochlorideN-(4-(2-Methoxyphenoxy)phenyl)-N-(2,2,2- trifluoroethylsulfonyl)pyrid-3-ylmethylamine hydrochloride2,2,2-trifluoro-N-[4-(2-methoxyphenoxy)phenyl]-N-(pyridin-3-ylmethyl)ethanesulfonamide:hydrochloride
2,2,2-Trifluoro-N-[4-(2-methoxyphenoxy)phenyl]-N-(3-pyridinylmethyl)ethanesulfonamide hydrochlorideLY 487379 Hydrochloride;LY 487379-d3 HydrochlorideUNII-UQP3N7RUC3353229-59-1 (HCl)C21H20ClF3N2O4Sorb1704385DTXSID50719337
Database identifiers
- CAS
353229-59-1- PubChem CID
- 56972206
- DTXSID
DTXSID50719337- UNII
- UQP3N7RUC3
Properties
Computed structural properties
- Topological polar surface area
- 77.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 8
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 648
Physicochemical properties
- storage temp.
- 2 · 2-8°C
- solubility
- 20 mg/mL · DMSO: >20mg/mL
- form
- powder
- color
- off-white
- FDA UNII
- 3 N7RUC3 · UQP3N7RUC3
- WGK Germany
- 3 · 3
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- wgk
- 3
Chemistry & industry
Applications
UsesLY 487379 Hydrochloride is a group II mGlu receptors activator with anti-hyperthermic effects. Allosteric potentiators of metabotropic glutamate receptor 2 (mGlu2).
Related reactions
0 records
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Compound notes
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