Research chemical
CAS Number: 674305-13-6
![7-[2-(1,3-Benzothiazol-2-ylsulfanyl)ethyl]-8-[4-(furan-2-carbonyl)piperazin-1-yl]-3-methylpurine-2,6-dione molecular structure, CAS 674305-13-6](/structure-images/674305-13-6.png?v=struct-v3)
Product details
For laboratory research and professional procurement workflows.
PubChem CID
3504279
Exact Mass
537.125295
InChIKey
QGMRXYVDXCRMDB-UHFFFAOYSA-N
SMILES String
Cn1c(=O)[nH]c(=O)c2c1nc(N1CCN(C(=O)c3ccco3)CC1)n2CCSc1nc2ccccc2s1
No physical property values available.
Properties are provided as catalog reference data and may be confirmed through supplier documentation when required.
Catalog navigation
Linked by recorded structural or research relationships, not interchangeable products. Check the exact CAS, specification and availability on the linked product page.
7-[2-(1,3-Benzothiazol-2-ylsulfanyl)ethyl]-8-[4-(furan-2-carbonyl)piperazin-1-yl]-3-methylpurine-2,6-dione is identified by CAS 674305-13-6, with molecular formula C24H23N7O4S2, molecular weight 537.6, InChIKey QGMRXYVDXCRMDB-UHFFFAOYSA-N.
Yes. Submit an RFQ and specify COA requirements. Lot-specific COA depends on supplier confirmation.
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Heavy atom count
37
H-bond acceptors
11
H-bond donors
1
Rotatable bonds
6
Ring count
6
Aromatic rings
5
Topological polar surface area
122.26 Ų
Computed LogP
2.38
Fragment-like structure rule
No
Lead-like structure rule
No
Drug-like structure rule
No
Structure family
n heterocycle ligand
Precious metal motif
No
Transition metal motif
No
Phosphine ligand motif
No
N-heterocycle motif
Yes
Boronic acid motif
No
Computed structure descriptors generated from molecular structure. These are not experimental physical property values, supplier specifications, SDS data, or bioactivity claims.
Structural features
7-[2-(1,3-Benzothiazol-2-ylsulfanyl)ethyl]-8-[4-(furan-2-carbonyl)piperazin-1-yl]-3-methylpurine-2,6-dione (CAS 674305-13-6) is maintained as a commercial cas reference with formula C24H23N7O4S2, molecular weight 537. 60 g/mol, PubChem CID 3504279.
Sourcing context
Catalog reference for RFQ preparation, supplier confirmation, and research chemical sourcing review.
Research use context
Use this page for CAS identity lookup, internal catalog search, and commercial discovery workflows; structure-derived tags include nitrogen-containing heterocycle.
Documentation needs
Review supplier documentation before handling; for research use only.
Safety and handling reference content is available through documentation requests.
For supplier-issued SDS, request documentation before handling, storage, shipment, or procurement decisions.