PDD00017273 HCl| CAS#1945950-21-9

MedKoo Cat#: 555435 | Name: PDD00017273 HCl

Description:

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

PDD00017273 is a Potent and selective poly (ADP ribose) glycohydrolase (PARG) inhibitor(IC50 = 26 nM). PDD00017273 exhibits >350-fold selectivity for PARG over a panel of ion channels, enzymes and receptors, including PARP1 and ARH3.

Chemical Structure

PDD00017273 HCl

CAS#1945950-21-9

Theoretical Analysis

MedKoo Cat#: 555435

Name: PDD00017273 HCl

CAS#: 1945950-21-9

Chemical Formula: C23H27ClN6O4S2

Exact Mass: 514.1457

Molecular Weight: 551.08

Elemental Analysis: C, 50.13; H, 4.94; Cl, 6.43; N, 15.25; O, 11.61; S, 11.64

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 #

1945950-21-9

Synonym

PDD00017273; PDD-00017273; PDD 00017273; PDD17273; PDD-17273; PDD 17273;

IUPAC/Chemical Name

1-[(1,3-Dimethyl-1H-pyrazol-5-yl)methyl]-1,2,3,4-tetrahydro-N-(1-methylcyclopropyl)-3-[(2-methyl-5-thiazolyl)methyl]-2,4-dioxo-6-quinazolinesulfonamide hydrochloride

InChi Key

PIBCFKLPKFMUHX-UHFFFAOYSA-N

InChi Code

InChI=1S/C23H26N6O4S2.ClH/c1-14-9-16(27(4)25-14)12-28-20-6-5-18(35(32,33)26-23(3)7-8-23)10-19(20)21(30)29(22(28)31)13-17-11-24-15(2)34-17;/h5-6,9-11,26H,7-8,12-13H2,1-4H3;1H

SMILES Code

O=S(C1=CC2=C(N(CC3=CC(C)=NN3C)C(N(CC4=CN=C(C)S4)C2=O)=O)C=C1)(NC5(C)CC5)=O.[H]Cl

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

Instruction

View handling instruction

Preparing Stock Solutions

The following data is based on the product molecular weight 551.08 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

1: Gravells P, Neale J, Grant E, Nathubhai A, Smith KM, James DI, Bryant HE. Radiosensitization with an inhibitor of poly(ADP-ribose) glycohydrolase: A comparison with the PARP1/2/3 inhibitor olaparib. DNA Repair (Amst). 2018 Jan;61:25-36. doi: 10.1016/j.dnarep.2017.11.004. Epub 2017 Nov 22. PubMed PMID: 29179156; PubMed Central PMCID: PMC5765821. 2: Gravells P, Grant E, Smith KM, James DI, Bryant HE. Specific killing of DNA damage-response deficient cells with inhibitors of poly(ADP-ribose) glycohydrolase. DNA Repair (Amst). 2017 Apr;52:81-91. doi: 10.1016/j.dnarep.2017.02.010. Epub 2017 Feb 17. PubMed PMID: 28254358; PubMed Central PMCID: PMC5360195.