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Jtv-519 free base structure
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Jtv-519 free base

TL;DR: Jtv-519 free base (CAS 145903-06-6) is a chemical compound with molecular formula C25H32N2O2S and molecular weight 424.21844 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

3-(4-benzylpiperidin-1-yl)-1-(7-methoxy-3,5-dihydro-2H-1,4-benzothiazepin-4-yl)propan-1-one

Also Known As: K201 free base, Jtv-519 free base, JTV519 Hemifumarate, JTV-519 (free base), K201 (free base)

CAS Number
145903-06-6
Molecular Formula
C25H32N2O2S
Molecular Weight
424.21844 g/mol
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Application Areas

Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.

Analytical Reagents (2 patents) Heterocyclic Building Blocks (4 patents) Pharmaceutical Intermediates (36 patents)

Technical Specifications

Molecular FormulaC25H32N2O2S
Molecular Weight424.21844 g/mol
XLogP4.1
Topological Polar Surface Area (TPSA)58.1 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors4
Rotatable Bonds6
Exact Mass424.21844 Da
Heavy Atoms30
Complexity531.0
SMILESCOC1=CC2=C(C=C1)SCCN(C2)C(=O)CCN3CCC(CC3)CC4=CC=CC=C4
InChIKeyKCWGETCFOVJEPI-UHFFFAOYSA-N

Chemical Property Profile of Jtv-519 free base

XLogP
4.1
TPSA (Topological Polar Surface Area)
58.1
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
4
Rotatable Bonds
6
Heavy Atoms
30
Complexity
531.0
Exact Mass
424.21844
Monoisotopic Mass
424.21844
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 Jtv-519 free base

The XLogP value of 4.1 indicates that Jtv-519 free base is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.1 Ų, Jtv-519 free base exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Jtv-519 free base has 0 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 Jtv-519 free base?

The CAS number of Jtv-519 free base is 145903-06-6.

What is the molecular formula of Jtv-519 free base?

The molecular formula of Jtv-519 free base is C25H32N2O2S.

What is the molecular weight of Jtv-519 free base?

The molecular weight of Jtv-519 free base is 424.21844 g/mol.

Where can I buy Jtv-519 free base?

You can request a quote for Jtv-519 free base directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Jtv-519 free base?

Yes, CoreyChem provides custom synthesis services for Jtv-519 free base and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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