WAY-299788 - 10mM in DMSO , CAS No.50693-74-8

CAS: 50693-74-8 Cat. No.: W424365 Molecular Weight: 278.32 PubChem CID: 706307
AVAILABLE TO ORDER
GRADE & PURITY 10mM in DMSO
Synonyms
1,3,7-trimethyl-8-(piperazin-1-yl)-2,3,6,7-tetrahydro-1H-purine-2,6-dione | SCHEMBL531646 | 1,3,7-Trimethyl-8-piperazin-1-yl-3,7-dihydro-purine-2,6-dione | DTXSID20351662 | 1,3,7-trimethyl-8-(piperazin-1-yl)-1h-purine-2,6(3h,7h)-dione | HMS1631L05 | AKOS0
Storage
Store at -80°C
Shipped In
Dry ice packs + Cold packs
Size
Status
Price
Qty
1ml
W424365-1ml
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$205.90

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Why this grade

10mM in DMSO for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Store at -80°C Ships Dry ice packs + Cold packs Check lot-specific COA for exact specifications.

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Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

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Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Overview

PARP inhibitors

Specifications

Synonyms
1, 3, 7-trimethyl-8-(piperazin-1-yl)-2, 3, 6, 7-tetrahydro-1H-purine-2, 6-dione | SCHEMBL531646 | 1, 3, 7-Trimethyl-8-piperazin-1-yl-3, 7-dihydro-purine-2, 6-dione | DTXSID20351662 | 1, 3, 7-trimethyl-8-(piperazin-1-yl)-1h-purine-2, 6(3h, 7h)-dione | HMS1631L05 | AKOS0
Specifications & Purity
10mM in DMSO
Storage
Store at -80°C
Shipped In
Dry ice packs + Cold packs
This product requires cold chain shipping. Ground and other economy services are not available.
Names and Identifiers
Canonical SmilesCN1C2=C(N=C1N3CCNCC3)N(C(=O)N(C2=O)C)C
IUPAC Name1,3,7-trimethyl-8-piperazin-1-ylpurine-2,6-dione
InChIKeyCWQBJMULHKYRNB-UHFFFAOYSA-N
INCHI1S/C12H18N6O2/c1-15-8-9(16(2)12(20)17(3)10(8)19)14-11(15)18-6-4-13-5-7-18/h13H,4-7H2,1-3H3
Isomeric SMILES CN1C2=C(N=C1N3CCNCC3)N(C(=O)N(C2=O)C)C
PubChem CID 706307
Molecular Weight 278.32

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

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📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganoheterocyclic compounds
ClassDiazinanes
SubclassPiperazines
Intermediate Tree Nodes Not available
Direct ParentN-arylpiperazines
Alternative Parents Xanthines  6-oxopurines  Alkaloids and derivatives  Dialkylarylamines  Pyrimidones  Aminoimidazoles  N-substituted imidazoles  Vinylogous amides  Heteroaromatic compounds  Ureas  Lactams  Azacyclic compounds  Dialkylamines  Organopnictogen compounds  Organic oxides  Organooxygen compounds  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents N-arylpiperazine - Xanthine - 6-oxopurine - Purinone - Imidazopyrimidine - Purine - Alkaloid or derivatives - Dialkylarylamine - Pyrimidone - Aminoimidazole - Pyrimidine - N-substituted imidazole - Vinylogous amide - Heteroaromatic compound - Azole - Imidazole - Urea - Lactam - Azacycle - Secondary aliphatic amine - Secondary amine - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Amine - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
DescriptionThis compound belongs to the class of organic compounds known as n-arylpiperazines. These are organic compounds containing a piperazine ring where the nitrogen ring atom carries an aryl group.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Certificates(CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Chemical and Physical Properties
Molecular Weight278.310 g/mol
XLogP3-0.600
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count1
Exact Mass278.149 Da
Monoisotopic Mass278.149 Da
Topological Polar Surface Area73.700 Ų
Heavy Atom Count20
Formal Charge0
Complexity424.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Solution Calculators
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