MedKoo Cat#: 463159 | Name: (±)-Asenapine-13C-d3 HCl

Description:

WARNING: This product is for research use only, not for human or veterinary use.

(±)-Asenapine-13C-d3 is intended for use as an internal standard for the quantification of (±)-asenapine by GC- or LC-MS. (±)-Asenapine is an atypical antipsychotic. It binds to dopamine D1-4, α-adrenergic, and histamine receptors, as well as the serotonin receptor subtypes 5-HT1A, 5-HT1B, 5-HT2A, 5-HT2B, 5-HT2C, 5-HT5A, 5-HT6, and 5-HT7. (±)-Asenapine inhibits the suppression of neuron firing induced by the 5-HT2A, dopamine D2, and α2-adrenergic receptor agonists 2,5-dimethoxy-4-iodoamphetamine, apomorphine, and clonidine, respectively, in rat brain. In vivo, (±)-asenapine increases extracellular dopamine levels in the medial prefrontal cortex, nucleus accumbens, and lateral striatum and suppresses the conditioned avoidance response in rats. It prevents acute and chronic phencyclidine-induced deficits in cued reversal learning in rats when administered at a dose of 0.075 mg/kg. Formulations containing asenapine have been used in the treatment of schizophrenia and bipolar I disorder.

Chemical Structure

(±)-Asenapine-13C-d3 HCl
(±)-Asenapine-13C-d3 HCl
CAS#1261392-55-5

Theoretical Analysis

MedKoo Cat#: 463159

Name: (±)-Asenapine-13C-d3 HCl

CAS#: 1261392-55-5

Chemical Formula: C16(13C)H14D3Cl2NO

Exact Mass: 325.0909

Molecular Weight: 326.24

Elemental Analysis: C, 62.89; H, 6.18; Cl, 21.73; N, 4.29; O, 4.90

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Synonym
(±)-Asenapine-13C-d3 HCl;
IUPAC/Chemical Name
(3aR,12bR)-5-chloro-2-(methyl-13C-d3)-2,3,3a,12b-tetrahydro-1H-dibenzo[2,3:6,7]oxepino[4,5-c]pyrrole hydrochloride
InChi Key
FNJQDKSEIVVULU-XSYCCUFUSA-N
InChi Code
InChI=1S/C17H16ClNO.ClH/c1-19-9-14-12-4-2-3-5-16(12)20-17-7-6-11(18)8-13(17)15(14)10-19;/h2-8,14-15H,9-10H2,1H3;1H/t14-,15-;/m0./s1/i1+1D3;
SMILES Code
[H][C@]12C3=C(OC4=C([C@@]1(CN(C2)[13C]([2H])([2H])[2H])[H])C=CC=C4)C=CC(Cl)=C3.Cl
Appearance
Solid powder
Purity
>98% (or refer to the Certificate of Analysis)
Shipping Condition
Shipped under ambient temperature as non-hazardous chemical. This product is stable enough for a few weeks during ordinary shipping and time spent in Customs.
Storage Condition
Dry, dark and at 0 - 4 C for short term (days to weeks) or -20 C for long term (months to years).
Solubility
Soluble in DMSO
Shelf Life
>3 years if stored properly
Drug Formulation
This drug may be formulated in DMSO
Stock Solution Storage
0 - 4 C for short term (days to weeks), or -20 C for long term (months).
HS Tariff Code
2934.99.9001
More Info

Preparing Stock Solutions

The following data is based on the product molecular weight 326.24 Batch specific molecular weights may vary from batch to batch due to the degree of hydration, which will affect the solvent volumes required to prepare stock solutions.

Recalculate based on batch purity %
Concentration / Solvent Volume / Mass 1 mg 5 mg 10 mg
1 mM 1.15 mL 5.76 mL 11.51 mL
5 mM 0.23 mL 1.15 mL 2.3 mL
10 mM 0.12 mL 0.58 mL 1.15 mL
50 mM 0.02 mL 0.12 mL 0.23 mL