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MW 434 Da, Purity >98%. Potent, selective orexin-2 receptor antagonist (IC50 = 40 nM). Neurological and insomnia agent. Active in vitro and in vivo.

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Chemical Structure - TCS OX2 29, Orexin-2 receptor antagonist (AB141316), expandable thumbnail

Key facts

CAS number
1610882-30-8
Purity
> 98%
Form
Solid
Molecular weight
434 Da
Molecular formula
C23H32ClN3O3
PubChem identifier
53302033
Nature
Synthetic

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MW 434 Da, Purity >98%. Potent, selective orexin-2 receptor antagonist (IC50 = 40 nM). Neurological and insomnia agent. Active in vitro and in vivo.

Key facts

Purity
> 98%
PubChem identifier
53302033
Solubility

Soluble in water to 100 mM.

Soluble in DMSO to 10mM.

Biochemical name
(2S)-1-(3,4-Dihydro-6,7-dimethoxy-2(1H)-isoquinolinyl)-3,3-dimethyl-2-[(4-pyridinylmethyl)amino]-1-butanone hydrochloride
Biological description

Potent, selective orexin-2 receptor antagonist (IC50 = 40 nM). Neurological and insomnia agent. Active in vitro and in vivo.

Canonical SMILES
CC(C)(C)C(C(=O)N1CCC2=CC(=C(C=C2C1)OC)OC)NCC3=CC=NC=C3.Cl
Isomeric SMILES
CC(C)(C)[C@@H](C(=O)N1CCC2=CC(=C(C=C2C1)OC)OC)NCC3=CC=NC=C3.Cl
InChI
InChI=1S/C23H31N3O3.ClH/c1-23(2,3)21(25-14-16-6-9-24-10-7-16)22(27)26-11-8-17-12-19(28-4)20(29-5)13-18(17)15-26;/h6-7,9-10,12-13,21,25H,8,11,14-15H2,1-5H3;1H/t21-;/m1./s1
InChIKey
NHKNHFJTMINMBP-ZMBIFBSDSA-N
IUPAC name
(2S)-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3,3-dimethyl-2-(pyridin-4-ylmethylamino)butan-1-one;hydrochloride

Storage

Shipped at conditions
Ambient - Can Ship with Ice
Appropriate short-term storage conditions
+4°C
Appropriate long-term storage conditions
+4°C
Storage information
Store under desiccating conditions, The product can be stored for up to 12 months

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1 product image

  • Chemical Structure - TCS OX2 29, Orexin-2 receptor antagonist (ab141316), expandable thumbnail

    Chemical Structure - TCS OX2 29, Orexin-2 receptor antagonist (ab141316)

    2D chemical structure image of ab141316, TCS OX2 29, Orexin-2 receptor antagonist

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Product protocols

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