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MedKoo Cat#: 575656 | Name: Metofenazate difumarate

Description:

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

Metofenazate difumarate is a selective calmodulin inhibitor.

Chemical Structure

Metofenazate difumarate
Metofenazate difumarate
CAS#522-23-6

Theoretical Analysis

MedKoo Cat#: 575656

Name: Metofenazate difumarate

CAS#: 522-23-6

Chemical Formula: C39H44ClN3O13S

Exact Mass: 829.2283

Molecular Weight: 830.30

Elemental Analysis: C, 56.42; H, 5.34; Cl, 4.27; N, 5.06; O, 25.05; S, 3.86

Price and Availability

This product is currently not in stock but may be available through custom synthesis. To ensure cost efficiency, the minimum order quantity is 1 gram. The estimated lead time is 2 to 4 months, with pricing dependent on the complexity of the synthesis (typically high for intricate chemistries). Quotes for quantities below 1 gram will not be provided. To request a quote, please click the button below. Note: If this product becomes available in stock in the future, pricing will be listed accordingly.
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Related CAS #
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Synonym
Frenolon; Methophenazate acid fumarate; Methophenazine difumarate; Metofenazate difumarate; T-82 difumarate; T2 difumarate
IUPAC/Chemical Name
Benzoic acid, 3,4,5-trimethoxy-, 2-(4-(3-(2-chlorophenothiazin-10-yl)propyl)-1-piperazinyl)ethyl ester, difumarate
InChi Key
ZDTAJBBRWBBHSZ-LVEZLNDCSA-N
InChi Code
InChI=1S/C31H36ClN3O5S.2C4H4O4/c1-37-26-19-22(20-27(38-2)30(26)39-3)31(36)40-18-17-34-15-13-33(14-16-34)11-6-12-35-24-7-4-5-8-28(24)41-29-10-9-23(32)21-25(29)35;2*5-3(6)1-2-4(7)8/h4-5,7-10,19-21H,6,11-18H2,1-3H3;2*1-2H,(H,5,6)(H,7,8)/b;2*2-1+
SMILES Code
COc1cc(cc(OC)c1OC)C(=O)OCCN2CCN(CCCN3c4ccccc4Sc5ccc(Cl)cc35)CC2.OC(=O)\C=C\C(=O)O.OC(=O)\C=C\C(=O)O
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

Preparing Stock Solutions

The following data is based on the product molecular weight 830.30 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. Tkachuk VA, Baldenkov GN, Feoktistov IA, Men'shikov MY, Quast U, Herzig JW. Metofenazate as a more selective calmodulin inhibitor than trifluoperazine. Arzneimittelforschung. 1987 Sep;37(9):1013-7. PMID: 2449225. 2. Bergstrand H, Eriksson T, Hallberg A, Johansson B, Karabelas K, Michelsen P, Nybom A. Modulation of neutrophil superoxide generation by inhibitors of protein kinase C, calmodulin, diacylglycerol and myosin light chain kinases, and peptidyl prolyl cis-trans isomerase. J Pharmacol Exp Ther. 1992 Dec;263(3):1334-46. PMID: 1281879. 3. Bergstrand H, Lundquist B. Human basophil histamine release is differently affected by inhibitors of calmodulin, diacylglycerol kinase and peptidyl prolyl cis-trans isomerase in a secretagogue specific manner. Allergy. 1992 Aug;47(4 Pt 2):353-61. doi: 10.1111/j.1398-9995.1992.tb02071.x. PMID: 1280915.

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