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Terlakiren structure
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Terlakiren

TL;DR: Terlakiren (CAS 119625-78-4) is a chemical compound with molecular formula C31H48N4O7S and molecular weight 620.32434 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

propan-2-yl (2R,3S)-4-cyclohexyl-2-hydroxy-3-[[(2R)-3-methylsulfanyl-2-[[(2S)-2-(morpholine-4-carbonylamino)-3-phenylpropanoyl]amino]propanoyl]amino]butanoate

Also Known As: Terlakiren, Terlakirene, Terlakireno, terlakirenum, cp-80,794

CAS Number
119625-78-4
Molecular Formula
C31H48N4O7S
Molecular Weight
620.32434 g/mol
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Application Areas

Top 5 of 8 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (6 patents) Analytical Reagents (4 patents) Biotechnology (6 patents) Heterocyclic Building Blocks (41 patents) Organic Building Blocks (5 patents)

Technical Specifications

Molecular FormulaC31H48N4O7S
Molecular Weight620.32434 g/mol
XLogP3.8
Topological Polar Surface Area (TPSA)172.0 Ų
Hydrogen Bond Donors4
Hydrogen Bond Acceptors8
Rotatable Bonds15
Exact Mass620.32434 Da
Heavy Atoms43
Complexity889.0
SMILESCC(C)OC(=O)[C@@H]([C@H](CC1CCCCC1)NC(=O)[C@H](CSC)NC(=O)[C@H](CC2=CC=CC=C2)NC(=O)N3CCOCC3)O
InChIKeyUZQBKCWYZBHBOW-YIPNQBBMSA-N

Chemical Property Profile of Terlakiren

XLogP
3.8
TPSA (Topological Polar Surface Area)
172.0
Hydrogen Bond Donors
4
Hydrogen Bond Acceptors
8
Rotatable Bonds
15
Heavy Atoms
43
Complexity
889.0
Exact Mass
620.32434
Monoisotopic Mass
620.32434
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 Terlakiren

The XLogP value of 3.8 indicates that Terlakiren is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 172.0 Ų indicates high polarity, suggesting Terlakiren may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Terlakiren 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 Terlakiren?

The CAS number of Terlakiren is 119625-78-4.

What is the molecular formula of Terlakiren?

The molecular formula of Terlakiren is C31H48N4O7S.

What is the molecular weight of Terlakiren?

The molecular weight of Terlakiren is 620.32434 g/mol.

Where can I buy Terlakiren?

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

Does CoreyChem offer custom synthesis for Terlakiren?

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

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