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Palinavir structure
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Palinavir

TL;DR: Palinavir (CAS 154612-39-2) is a chemical compound with molecular formula C41H52N6O5 and molecular weight 708.3999 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

N-[(2S)-1-[[(2S,3R)-4-[(2S,4R)-2-(tert-butylcarbamoyl)-4-(pyridin-4-ylmethoxy)piperidin-1-yl]-3-hydroxy-1-phenylbutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]quinoline-2-carboxamide

Also Known As: Palinavir, palinavirum, BILA 2011 BS, PALINAVIR [INN], Palinavir (USAN/INN)

CAS Number
154612-39-2
Molecular Formula
C41H52N6O5
Molecular Weight
708.3999 g/mol
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Application Areas

Top 5 of 9 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (7 patents) Analytical Reagents (5 patents) Biotechnology (29 patents) Catalysts (1 patents) Heterocyclic Building Blocks (649 patents)

Technical Specifications

Molecular FormulaC41H52N6O5
Molecular Weight708.3999 g/mol
XLogP5.1
Topological Polar Surface Area (TPSA)146.0 Ų
Hydrogen Bond Donors4
Hydrogen Bond Acceptors8
Rotatable Bonds15
Exact Mass708.3999 Da
Heavy Atoms52
Complexity1140.0
SMILESCC(C)[C@@H](C(=O)N[C@@H](CC1=CC=CC=C1)[C@@H](CN2CC[C@H](C[C@H]2C(=O)NC(C)(C)C)OCC3=CC=NC=C3)O)NC(=O)C4=NC5=CC=CC=C5C=C4
InChIKeyRXBWRFDZXRAEJT-SZNOJMITSA-N

Chemical Property Profile of Palinavir

XLogP
5.1
TPSA (Topological Polar Surface Area)
146.0
Hydrogen Bond Donors
4
Hydrogen Bond Acceptors
8
Rotatable Bonds
15
Heavy Atoms
52
Complexity
1140.0
Exact Mass
708.3999
Monoisotopic Mass
708.3999
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 Palinavir

The XLogP value of 5.1 indicates that Palinavir is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 146.0 Ų indicates high polarity, suggesting Palinavir may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Palinavir has 4 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of Palinavir?

The CAS number of Palinavir is 154612-39-2.

What is the molecular formula of Palinavir?

The molecular formula of Palinavir is C41H52N6O5.

What is the molecular weight of Palinavir?

The molecular weight of Palinavir is 708.3999 g/mol.

Where can I buy Palinavir?

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

Does CoreyChem offer custom synthesis for Palinavir?

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

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