Zamicastat

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

MedKoo CAT#: 319706

CAS#: 1080028-80-3 (free base)

Description: Zamicastat is a potent and selective dopamine β-mono-oxygenase inhibitor. Zamicastat Prevents the Deterioration of Cardiometabolic and Inflammatory Biomarkers in a Genetic Model of Salt-sensitive Hypertension. Chronic high salt intake deteriorates several cardiometabolic and inflammatory biomarkers in Dahl/SS rats, which can be prevented by dopamine β-hydroxylase inhibition with zamicastat.


Chemical Structure

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Zamicastat
CAS# 1080028-80-3 (free base)

Theoretical Analysis

MedKoo Cat#: 319706
Name: Zamicastat
CAS#: 1080028-80-3 (free base)
Chemical Formula: C21H21F2N3OS
Exact Mass: 401.1373
Molecular Weight: 401.4758
Elemental Analysis: C, 62.83; H, 5.27; F, 9.46; N, 10.47; O, 3.99; S, 7.99

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Related CAS #: 1080028-80-3 (free base)   1383828-47-4 (HCl)    

Synonym: Zamicastat

IUPAC/Chemical Name: (R)-5-(2-(benzylamino)ethyl)-1-(6,8-difluorochroman-3-yl)-1,3-dihydro-2H-imidazole-2-thione

InChi Key: ZSSLCFLHEFXANG-GOSISDBHSA-N

InChi Code: InChI=1S/C21H21F2N3OS/c22-16-8-15-9-18(13-27-20(15)19(23)10-16)26-17(12-25-21(26)28)6-7-24-11-14-4-2-1-3-5-14/h1-5,8,10,12,18,24H,6-7,9,11,13H2,(H,25,28)/t18-/m1/s1

SMILES Code: S=C(N1[C@@H]2CC3=CC(F)=CC(F)=C3OC2)NC=C1CCNCC4=CC=CC=C4

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, not in water

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

Preparing Stock Solutions

The following data is based on the product molecular weight 401.4758 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

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Additional Information

Related CAS#
1080028-80-3 ( Zamicastat free base)
1383828-47-4 ( Zamicastat HCl salt).