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MedKoo Cat#: 574062 | Name: PDD-00017272
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Description:

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

PDD-00017272 is a potent poly (ADP ribose) glycohydrolase (PARG) inhibitor.

Chemical Structure

PDD-00017272
PDD-00017272
CAS#1945950-20-8

Theoretical Analysis

MedKoo Cat#: 574062

Name: PDD-00017272

CAS#: 1945950-20-8

Chemical Formula: C23H25N5O4S3

Exact Mass: 531.1069

Molecular Weight: 531.66

Elemental Analysis: C, 51.96; H, 4.74; N, 13.17; O, 12.04; S, 18.09

Price and Availability

Size Price Availability Quantity
1mg USD 300.00
10mg USD 545.00
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Related CAS #
No Data
Synonym
PDD-00017272, PDD00017272, PDD 00017272
IUPAC/Chemical Name
1-[(2,4-Dimethyl-5-thiazolyl)methyl]-1,2,3,4-tetrahydro-N-(1-methylcyclopropyl)-3-[(2-methyl-5-thiazolyl)methyl]-2,4-dioxo-6-quinazolinesulfonamide
InChi Key
QOEXRJYTAZZRPL-UHFFFAOYSA-N
InChi Code
InChI=1S/C23H25N5O4S3/c1-13-20(34-15(3)25-13)12-27-19-6-5-17(35(31,32)26-23(4)7-8-23)9-18(19)21(29)28(22(27)30)11-16-10-24-14(2)33-16/h5-6,9-10,26H,7-8,11-12H2,1-4H3
SMILES Code
CC1=NC=C(S1)CN2C(N(C3=CC=C(S(=O)(NC4(CC4)C)=O)C=C3C2=O)CC5=C(N=C(S5)C)C)=O
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 531.66 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
Waszkowycz et al (2018) Cell-active small molecule inhibitors of the DNA-damage repair enzyme poly(ADP-ribose) glycohydrolase (PARG): discovery and optimization of orally bioavailable quinazolinedione sulfonamides. J.Med.Chem. 61 10767 PMID: 30403352