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DU 717 structure
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DU 717

TL;DR: DU 717 (CAS 59943-31-6) is a chemical compound with molecular formula C12H15ClN4O2S and molecular weight 314.06042 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

7-chloro-3-(4-methylpiperazin-1-yl)-4H-1λ6,2,4-benzothiadiazine 1,1-dioxide

Also Known As: DU717, DU 717, HY-U00182, 2H-1,2,4-BENZOTHIADIAZINE, 7-CHLORO-3-(4-METHYL-1-PIPERAZINYL)-, 1,1-DIOXIDE, 7-chloro-3-(4-methylpiperazin-1-yl)-4H-1

CAS Number
59943-31-6
Molecular Formula
C12H15ClN4O2S
Molecular Weight
314.06042 g/mol
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Application Areas

Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.

Heterocyclic Building Blocks (1 patents) Pharmaceutical Intermediates (1 patents)

Technical Specifications

Molecular FormulaC12H15ClN4O2S
Molecular Weight314.06042 g/mol
XLogP1.0
Topological Polar Surface Area (TPSA)73.4 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors4
Rotatable Bonds1
Exact Mass314.06042 Da
Heavy Atoms20
Complexity496.0
SMILESCN1CCN(CC1)C2=NS(=O)(=O)C3=C(N2)C=CC(=C3)Cl
InChIKeyJPZVJONKWYICFB-UHFFFAOYSA-N

Chemical Property Profile of DU 717

XLogP
1.0
TPSA (Topological Polar Surface Area)
73.4
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
4
Rotatable Bonds
1
Heavy Atoms
20
Complexity
496.0
Exact Mass
314.06042
Monoisotopic Mass
314.06042
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of DU 717

The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for DU 717. The TPSA of 73.4 Ų falls within the moderate polarity range, balancing permeability and solubility for DU 717. Following Lipinski's Rule of Five, DU 717 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of DU 717?

The CAS number of DU 717 is 59943-31-6.

What is the molecular formula of DU 717?

The molecular formula of DU 717 is C12H15ClN4O2S.

What is the molecular weight of DU 717?

The molecular weight of DU 717 is 314.06042 g/mol.

Where can I buy DU 717?

You can request a quote for DU 717 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for DU 717?

Yes, CoreyChem provides custom synthesis services for DU 717 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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