CX-546

HCID 2890CAS 215923-54-9

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Basic information

Standard SMILES: O=C(c1ccc2c(c1)OCCO2)N1CCCCC1
InChIKey: LJUNPHMOGNFFOS-UHFFFAOYSA-N
Molecular formula: C14H17NO3
Average molar mass: 247.29 g/mol
Monoisotopic mass: 247.1208434

Names & identifiers

Preferred name: CX-546
IUPAC: 2,3-dihydro-1,4-benzodioxin-6-yl(piperidin-1-yl)methanone
English name: CX546 (1-(1,4-benzodioxan-6-ylcarbonyl)p
Molecular formula: C14H17NO3
Molecular weight: 247.29

Names & synonyms

CX546CX 546CX-546BDP 17GR 87BDP-17PV6YEC8983GR-872,3-Dihydro-1,4-benzodioxin-7-yl-(1-piperidyl)methanone1-[(2,3-Dihydro-1,4-benzodioxin-6-yl)carbonyl]piperidineMethanone, (2,3-dihydro-1,4-benzodioxin-6-yl)-1-piperidinyl-Piperidine, 1-((2,3-dihydro-1,4-benzodioxin-6-yl)carbonyl)-

Show more names

BDP-17,CX546,GR87CX 546, AMPA receptor potentiator1-(2,3-Dihydro-1,4-benzodioxin-6-ylcarbonyl)piperidine

1-((2,3-dihydro-1,4-benzodioxin-6-yl)carbonyl)piperidineRefChem:919303215923-54-9(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)(piperidin-1-yl)methanone2,3-dihydro-1,4-benzodioxin-6-yl(piperidin-1-yl)methanone1-(1,4-Benzodioxan-6-ylcarbonyl)piperidine(2,3-Dihydro-1,4-benzodioxin-6-yl)-1-piperidinylmethanoneCX546 (1-(1,4-BENZODIOXAN-6-YLCARBONYL)P

Database identifiers

CAS: 215923-54-9
PubChem CID: 2890
DTXSID: DTXSID70175951
ChEMBL: CHEMBL1255648
UNII: PV6YEC8983
Nikkaji: J1.630.116G

Properties

Computed structural properties

XLogP: 1.1
Topological polar surface area: 38.8 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 3
Rotatable bonds: 1
Heavy atoms: 18
Formal charge: 0
Complexity: 301

Physicochemical properties

Melting point: 71 · 71-73°C
Boiling point: 422.8 · 422.8±44.0 °C(Predicted)
Density: 1 · 1+-.0.06 g/cm3(Predicted)
storage temp.: 2 · 2-8°C
solubility: 10 mg/mL · DMSO: ≥10mg/mL
pka: -1.08 · -1.08±0.20(Predicted)
form: solid
color: white to off-white
InChI: 1S/C14H17NO3/c16-14(15-6-2-1-3-7-15)11-4-5-12-13(10-11)18-9-8-17-12/h4-5,10H,1-3,6-9H2
InChIKey: LJUNPHMOGNFFOS-UHFFFAOYSA-N
SMILES: O=C(N1CCCCC1)c2ccc3OCCOc3c2
FDA UNII: 6 YEC8983 · PV6YEC8983
UNSPSC Code: 12352200 · 12352200
NACRES: 77 · NA.77
PPE: 95 · Eyeshields, Gloves, type N95 (US)
WGK Germany: 3 · 3
Storage Class: 11 · 11 - Combustible Solids

Safety & regulation

Safety data

PPE: Eyeshields, Gloves, type N95 (US)
wgk: 3
Storage Class: 11 - Combustible Solids

Chemistry & industry

Applications · 3 items

UsesIt is one of a series of AMPA modulators matergic AMPA receptors.

UsesCX546 has been used as positive allosteric modulator for the glutamatergic receptor α-amino-3-hydroxy-5-methyl-4-isoxazolepropionic acid (AMPA) in mice.

General DescriptionCX546, a benzoylpiperidine derivative ampakine is an analog of CX516.

Suppliers50 total

广州诚创生物科技有限公司18027266590 · [email protected]

陕西缔都医药有限责任公司029-81124775 17791530730 · [email protected]

上海优宁维生物科技股份有限公司15921930842 15921930842 · [email protected]

上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]

武汉易泰科技有限公司上海分公司18930552037 · [email protected]

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