MedKoo Cat#: 564947 | Name: PYSOCA Substrate-1

Description:

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

PYSOCA Substrate-1 is a BBB-permeable substrate of pyrilamine-sensitive proton-coupled organic cation antiporter (PYSOCA) which acts as a selective class I HDAC inhibitor.

Chemical Structure

PYSOCA Substrate-1
PYSOCA Substrate-1
CAS#NONE

Theoretical Analysis

MedKoo Cat#: 564947

Name: PYSOCA Substrate-1

CAS#: NONE

Chemical Formula: C24H29N5O2

Exact Mass: 419.2321

Molecular Weight: 419.53

Elemental Analysis: C, 68.71; H, 6.97; N, 16.69; O, 7.63

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
PYSOCA Substrate-1; PYSOCA Substrate 1; PYSOCA Substrate1
IUPAC/Chemical Name
N-(2-Aminophenyl)-6-((2-(dimethylamino)ethyl)(4-methoxybenzyl)amino)nicotinamide
InChi Key
XRDCTVBYPFNFSI-UHFFFAOYSA-N
InChi Code
InChI=1S/C24H29N5O2/c1-28(2)14-15-29(17-18-8-11-20(31-3)12-9-18)23-13-10-19(16-26-23)24(30)27-22-7-5-4-6-21(22)25/h4-13,16H,14-15,17,25H2,1-3H3,(H,27,30)
SMILES Code
O=C(NC1=CC=CC=C1N)C2=CN=C(N(CCN(C)C)CC3=CC=C(OC)C=C3)C=C2
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 419.53 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: Hiranaka S, Tega Y, Higuchi K, Kurosawa T, Deguchi Y, Arata M, Ito A, Yoshida M, Nagaoka Y, Sumiyoshi T. Design, Synthesis, and Blood-Brain Barrier Transport Study of Pyrilamine Derivatives as Histone Deacetylase Inhibitors. ACS Med Chem Lett. 2018 Aug 23;9(9):884-888. doi: 10.1021/acsmedchemlett.8b00099. eCollection 2018 Sep 13. PubMed PMID: 30258535; PubMed Central PMCID: PMC6142051.