MedKoo Cat#: 464856 | Name: DDO-2213

Description:

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

DDO-2213 is a Potent and Orally Bioavailable Inhibitor of the WDR5−Mixed Lineage Leukemia 1 Protein−Protein Interaction for the Treatment of MLL Fusion Leukemia.

Chemical Structure

DDO-2213
DDO-2213
CAS#unknown

Theoretical Analysis

MedKoo Cat#: 464856

Name: DDO-2213

CAS#: unknown

Chemical Formula: C24H28ClFN8O

Exact Mass: 498.2059

Molecular Weight: 498.99

Elemental Analysis: C, 57.77; H, 5.66; Cl, 7.10; F, 3.81; N, 22.46; O, 3.21

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
DDO-2213; DDO2213; DDO 2213;
IUPAC/Chemical Name
3-(5'-((5-amino-6-chloropyrimidin-4-yl)amino)-2'-fluoro-4'-(4-methylpiperazin-1-yl)-[1,1'-biphenyl]-4-yl)-1,1-dimethylurea
InChi Key
VAXKDJXJCBGPOZ-UHFFFAOYSA-N
InChi Code
InChI=1S/C24H28ClFN8O/c1-32(2)24(35)30-16-6-4-15(5-7-16)17-12-19(31-23-21(27)22(25)28-14-29-23)20(13-18(17)26)34-10-8-33(3)9-11-34/h4-7,12-14H,8-11,27H2,1-3H3,(H,30,35)(H,28,29,31)
SMILES Code
FC1=CC(N2CCN(C)CC2)=C(NC3=C(N)C(Cl)=NC=N3)C=C1C4=CC=C(NC(N(C)C)=O)C=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
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

Preparing Stock Solutions

The following data is based on the product molecular weight 498.99 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: Chen W, Chen X, Li D, Zhou J, Jiang Z, You Q, Guo X. Discovery of DDO-2213 as a Potent and Orally Bioavailable Inhibitor of the WDR5-Mixed Lineage Leukemia 1 Protein-Protein Interaction for the Treatment of MLL Fusion Leukemia. J Med Chem. 2021 Jun 24;64(12):8221-8245. doi: 10.1021/acs.jmedchem.1c00091. Epub 2021 Jun 9. PMID: 34105966.