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MedKoo Cat#: 561051 | Name: Benzetimide HCl
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Description:

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

Benzetimide HCl, also known as EINECS 227-072-8, Spasmentral, and Dioxatrine, is a muscarinic acetylcholine receptor antagonist. Benzetimide HCl has been used to treat neuroleptic-induced parkinsonism. Benzetimide is an enantiomer of dexetimide.

Chemical Structure

Benzetimide HCl
Benzetimide HCl
CAS#5633-14-7 (HCl)

Theoretical Analysis

MedKoo Cat#: 561051

Name: Benzetimide HCl

CAS#: 5633-14-7 (HCl)

Chemical Formula: C23H27ClN2O2

Exact Mass: 0.0000

Molecular Weight: 398.93

Elemental Analysis: C, 69.25; H, 6.82; Cl, 8.89; N, 7.02; O, 8.02

Price and Availability

Size Price Availability Quantity
100mg USD 250.00 2 Weeks
200mg USD 450.00 2 Weeks
500mg USD 950.00 2 Weeks
1g USD 1,650.00 2 Weeks
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Related CAS #
14051-33-3 (free base) 5633-14-7 (HCl)
Synonym
Benzetimide HCl; Benzetimide Hydrochloride; EINECS 227-072-8; Spasmentral; Dioxatrine; R 4929; R4929; R-4929;
IUPAC/Chemical Name
3-(1-benzylpiperidin-4-yl)-3-phenylpiperidine-2,6-dione,hydrochloride
InChi Key
XSOOSXRNMDUWEM-UHFFFAOYSA-N
InChi Code
InChI=1S/C23H26N2O2.ClH/c26-21-11-14-23(22(27)24-21,19-9-5-2-6-10-19)20-12-15-25(16-13-20)17-18-7-3-1-4-8-18;/h1-10,20H,11-17H2,(H,24,26,27);1H
SMILES Code
O=C(C(C1=CC=CC=C1)(C2CCN(CC3=CC=CC=C3)CC2)CC4)NC4=O.[H]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
>2 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
Solvent mg/mL mM
Solubility
DMSO 32.0 80.21
Note: There can be variations in solubility for the same chemical from different vendors or different batches from the same vendor. The following factors can affect the solubility of the same chemical: solvent used for crystallization, residual solvent content, polymorphism, salt versus free form, degree of hydration, solvent temperature. Please use the solubility data as a reference only. Warming and sonication will facilitate dissolving. Still have questions? Please contact our Technical Support scientists.

Preparing Stock Solutions

The following data is based on the product molecular weight 398.93 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
1: Blankesteijn WM, Siero HL, Rodrigues de Miranda JF, van Megen YJ, Russel FG. Characterization of muscarinic receptors in rat kidney. Eur J Pharmacol. 1993 Jan 4;244(1):21-7. PubMed PMID: 8420789. 2: DeHaven-Hudkins DL, Ford-Rice FY, Allen JT, Hudkins RL. Allosteric modulation of ligand binding to [3H](+)pentazocine-defined sigma recognition sites by phenytoin. Life Sci. 1993;53(1):41-8. PubMed PMID: 8515681.