MedKoo Cat#: 564882 | Name: LDN-213844

Description:

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

LDN-213844 is an ALK2 inhibitor.

Chemical Structure

LDN-213844
LDN-213844
CAS#NONE

Theoretical Analysis

MedKoo Cat#: 564882

Name: LDN-213844

CAS#: NONE

Chemical Formula: C24H27N3O3

Exact Mass: 405.2052

Molecular Weight: 405.50

Elemental Analysis: C, 71.09; H, 6.71; N, 10.36; O, 11.84

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 #
No Data
Synonym
Desmethyl LDN-214117; LDN-213844; LDN213844; LDN 213844
IUPAC/Chemical Name
1-[4-[5-(3,4,5-Trimethoxyphenyl)pyridin-3-yl]phenyl]piperazine
InChi Key
WFZZPLAPENBNIY-UHFFFAOYSA-N
InChi Code
InChI=1S/C24H27N3O3/c1-28-22-13-18(14-23(29-2)24(22)30-3)20-12-19(15-26-16-20)17-4-6-21(7-5-17)27-10-8-25-9-11-27/h4-7,12-16,25H,8-11H2,1-3H3
SMILES Code
COC1=C(OC)C(OC)=CC(C2=CN=CC(C3=CC=C(N4CCNCC4)C=C3)=C2)=C1
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 405.50 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: Kausar T, Nayeem SM. Identification of small molecule inhibitors of ALK2: a virtual screening, density functional theory, and molecular dynamics simulations study. J Mol Model. 2018 Aug 29;24(9):262. doi: 10.1007/s00894-018-3789-2. PubMed PMID: 30159679.