TAK418 HCl

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MedKoo CAT#: 465455

CAS#: 1818252-53-7 (HCl)

Description: TAK-418 is a novel inhibitor of the epigenetic modulator lysine-specific demethylase 1A (LSD1).

Chemical Structure

TAK418 HCl
CAS# 1818252-53-7 (HCl)

Theoretical Analysis

MedKoo Cat#: 465455
Name: TAK418 HCl
CAS#: 1818252-53-7 (HCl)
Chemical Formula: C17H25ClN2O2S
Exact Mass: 0.00
Molecular Weight: 356.909
Elemental Analysis: C, 57.21; H, 7.06; Cl, 9.93; N, 7.85; O, 8.97; S, 8.98

Price and Availability

Size Price Availability Quantity
5mg USD 1150 2 Weeks
10g USD 1950 2 Weeks
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Related CAS #: 1818252-52-6 (free base), 1818252-53-7 (HCl),

Synonym: TAK418 HCl; TAK418 hydrochloride; TAK-418; TAK418; TAK 418;

IUPAC/Chemical Name: 5-((2R)-2-((cyclopropylmethyl)amino)cyclopropyl)-N-(tetrahydro-2H-pyran-4-yl)thiophene-3-carboxamide hydrochloride


InChi Code: InChI=1S/C17H24N2O2S.ClH/c20-17(19-13-3-5-21-6-4-13)12-7-16(22-10-12)14-8-15(14)18-9-11-1-2-11;/h7,10-11,13-15,18H,1-6,8-9H2,(H,19,20);1H/t14?,15-;/m1./s1


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: To be determined

Shelf Life: >2 years if stored properly

Drug Formulation: To be determined

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

Product Data:

Preparing Stock Solutions

The following data is based on the product molecular weight 356.909000000000000000000000000000 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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1: Yin W, Arkilo D, Khudyakov P, Hazel J, Gupta S, Quinton MS, Lin J, Hartman DS, Bednar MM, Rosen L, Wendland JR. Safety, pharmacokinetics and pharmacodynamics of TAK-418, a novel inhibitor of the epigenetic modulator lysine-specific demethylase 1A. Br J Clin Pharmacol. 2021 May 14. doi: 10.1111/bcp.14912. Epub ahead of print. PMID: 33990969.