XJTU-L453 | PI3Kα Inhibitor

MedKoo Cat#: 127665 | Name: XJTU-L453

Description:

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

XJTU-L453 is a PI3Kα Inhibitor (IC50 = 0.4 nM). XJTU-L453 was identified with PI3Kα inhibitory potency and unique selectivity over other PI3K isoforms and all other kinases tested.

Chemical Structure

XJTU-L453

CAS#N/A

Theoretical Analysis

MedKoo Cat#: 127665

Name: XJTU-L453

CAS#: N/A

Chemical Formula: C22H22N4O3

Exact Mass: 390.1692

Molecular Weight: 390.44

Elemental Analysis: C, 67.68; H, 5.68; N, 14.35; O, 12.29

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.

Bulk Inquiry

Related CAS #

No Data

Synonym

XJTU-L453; XJTU L453; XJTUL453

IUPAC/Chemical Name

(S)-2-((9-(6-(ethylamino)pyrimidin-4-yl)-6H-benzo[c]chromen-3-yl)oxy)propanamide

InChi Key

ZAAQWCBZFVQJNN-ZDUSSCGKSA-N

InChi Code

InChI=1S/C22H22N4O3/c1-3-24-21-10-19(25-12-26-21)14-4-5-15-11-28-20-9-16(29-13(2)22(23)27)6-7-17(20)18(15)8-14/h4-10,12-13H,3,11H2,1-2H3,(H2,23,27)(H,24,25,26)/t13-/m0/s1

SMILES Code

O=C(N)[C@H](C)OC1=CC2=C(C=C1)C3=C(C=CC(C4=NC=NC(NCC)=C4)=C3)CO2

Appearance

To be determined

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

More Info

Instruction

View handling instruction

Preparing Stock Solutions

The following data is based on the product molecular weight 390.44 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.

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

Shi X, Feng H, Tian H, Ma H, Pang X, Mao C, Xiang P, Xu Z, Han W, Yan Y, Chen W, Nan Y, Nan G, Hu Z, Hui L, Li C, Li Y. Rational Design of a Novel 6H-Benzo[c]chromen Series as Selective PI3Kα Inhibitors. J Med Chem. 2024 Aug 19. doi: 10.1021/acs.jmedchem.4c00992. Epub ahead of print. PMID: 39159497.