CAS 211735-76-1 Farampator (HCID 4118151)

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Basic information

CAS: 211735-76-1
Standard SMILES: O=C(c1ccc2nonc2c1)N1CCCCC1
InChIKey: XFVRBYKKGGDPAJ-UHFFFAOYSA-N
Molecular formula: C12H13N3O2
Average molar mass: 231.25 g/mol
Monoisotopic mass: 231.10077666

Overview

Farampator is under investigation in clinical trial NCT00113022 (Org 24448 to Treat Major Depression).

Names & identifiers

Preferred name: Farampator
IUPAC: 2,1,3-benzoxadiazol-5-yl(piperidin-1-yl)methanone
English name: FARAMPATOR
Molecular formula: C12H13N3O2
Molecular weight: 231.25

Names & synonyms

Farampator211735-76-1CX-691CX691Org 24448Org-24448CX 6917X6P5N8K2LSCH-900460DTXSID90175413Piperidine, 1-(2,1,3-benzoxadiazol-5-ylcarbonyl)-farampatorum

Show more names

Org2444ORG2444Org24448, CX-691Farampator (CX691）Farampator, 10 mM in DMSOFarampator (CX-691, Org24448)

RefChem:9214655-(piperidine-1-carbonyl)-2,1,3-benzoxadiazoleDTXCID0097904Farampator-d10benzo[c][1,2,5]oxadiazol-5-yl(piperidin-1-yl)methanone1-(2,1,3-Benzoxadiazol-5-ylcarbonyl)piperidineCX-691;Org244481-(Benzofurazan-5-ylcarbonyl)piperidine

Database identifiers

CAS: 211735-76-1
PubChem CID: 4118151
DTXSID: DTXSID90175413
ChEMBL: CHEMBL1276138
UNII: 7X6P5N8K2L
Nikkaji: J2.510.656C

Properties

Computed structural properties

XLogP: 1.5
Topological polar surface area: 59.2 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 4
Rotatable bonds: 1
Heavy atoms: 17
Formal charge: 0
Complexity: 291

Physicochemical properties

Boiling point: 398.3 · 398.3±34.0 °C(Predicted)
Density: 1.299 · 1.299±0.06 g/cm3(Predicted)
storage temp.: -20 °C · Sealed in dry,Store in freezer, under -20°C
solubility: 30 mg/ml; · DMF: 30 mg/ml; DMF:PBS (pH7.2) (1:40): 25μg/ml; DMSO: 20 mg/ml
form: A crystalline solid
pka: -1.33 · -1.33±0.36(Predicted)
color: White to off-white
FDA UNII: 7 X6P5N8K2L · 7X6P5N8K2L
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302-H315-H319-H335
Precautionary statements: 261 · P261-P264-P270-P271-P280-P301+P312-P330-P302+P352-P321-P304+P340-P305+P351+P338-P332+P313-P362+P364-P337+P313-P403+P233-P405-P501

Safety & regulation

Safety data

Signal word: Warning
Symbol(GHS): GHS07
Hazard statements: H302-H315-H319-H335
Precautionary statements: P261-P264-P270-P271-P280-P301+P312-P330-P302+P352-P321-P304+P340-P305+P351+P338-P332+P313-P362+P364-P337+P313-P403+P233-P405-P501

Chemistry & industry

Applications · 1 item

UsesFarampator has shown effects as an AMPA receptor potentiator and glycine reuptake inhibitor with potential anti-psychotic efficacy and enhancement of prefrontal glutamatergic transmission. Farampator’s effects on both AMPA-PAMs and GlyT-1 inhibitor maybe also improve cognitive impairments in schizophrenia and in particular when combied with Risperidone (R525000).