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H-bAla(2-OH,3-iBu)-Val-Val-Asp-OH structure
Fine Chemical

H-bAla(2-OH,3-iBu)-Val-Val-Asp-OH

TL;DR: H-bAla(2-OH,3-iBu)-Val-Val-Asp-OH (CAS 67655-94-1) is a chemical compound with molecular formula C21H38N4O8 and molecular weight 474.26895 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-[[2-[[2-[(3-amino-2-hydroxy-5-methylhexanoyl)amino]-3-methylbutanoyl]amino]-3-methylbutanoyl]amino]butanedioic acid

Also Known As: Amastatin, SMP2_000284, H-bAla(2-OH,3-iBu)-Val-Val-Asp-OH, (2S,3R)-[3-AMINO-2-HYDROXY-5-METHYLHEXANOYL]-VAL-VAL-ASP-OH HCL, [(2S,3R)-3-Amino-2-Hydroxy-5-Methyl-hexanoyl]-L-Valyl-L-Valyl-L-Aspartic Acid

CAS Number
67655-94-1
Molecular Formula
C21H38N4O8
Molecular Weight
474.26895 g/mol
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Technical Specifications

Molecular FormulaC21H38N4O8
Molecular Weight474.26895 g/mol
XLogP-2.0
Topological Polar Surface Area (TPSA)208.0 Ų
Hydrogen Bond Donors7
Hydrogen Bond Acceptors9
Rotatable Bonds14
Exact Mass474.26895 Da
Heavy Atoms33
Complexity710.0
SMILESCC(C)CC(C(C(=O)NC(C(C)C)C(=O)NC(C(C)C)C(=O)NC(CC(=O)O)C(=O)O)O)N
InChIKeyQFAADIRHLBXJJS-UHFFFAOYSA-N

Product Description

Applications: H-bAla(2-OH,3-iBu)-Val-Val-Asp-OH is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).

H-bAla(2-OH,3-iBu)-Val-Val-Asp-OH is a fine chemical identified by CAS number 67655-94-1 and the molecular formula C21H38N4O8 and a molecular weight of 474.27 g/mol. Synonyms include Amastatin and IAM-4095-V.

Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.

Chemical Property Profile of H-bAla(2-OH,3-iBu)-Val-Val-Asp-OH

XLogP
-2.0
TPSA (Topological Polar Surface Area)
208.0
Hydrogen Bond Donors
7
Hydrogen Bond Acceptors
9
Rotatable Bonds
14
Heavy Atoms
33
Complexity
710.0
Exact Mass
474.26895
Monoisotopic Mass
474.26895
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 H-bAla(2-OH,3-iBu)-Val-Val-Asp-OH

The XLogP value of -2.0 indicates that H-bAla(2-OH,3-iBu)-Val-Val-Asp-OH is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 208.0 Ų indicates high polarity, suggesting H-bAla(2-OH,3-iBu)-Val-Val-Asp-OH may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, H-bAla(2-OH,3-iBu)-Val-Val-Asp-OH has 7 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of H-bAla(2-OH,3-iBu)-Val-Val-Asp-OH?

The CAS number of H-bAla(2-OH,3-iBu)-Val-Val-Asp-OH is 67655-94-1.

What is the molecular formula of H-bAla(2-OH,3-iBu)-Val-Val-Asp-OH?

The molecular formula of H-bAla(2-OH,3-iBu)-Val-Val-Asp-OH is C21H38N4O8.

What is the molecular weight of H-bAla(2-OH,3-iBu)-Val-Val-Asp-OH?

The molecular weight of H-bAla(2-OH,3-iBu)-Val-Val-Asp-OH is 474.26895 g/mol.

What are the applications of H-bAla(2-OH,3-iBu)-Val-Val-Asp-OH?

H-bAla(2-OH,3-iBu)-Val-Val-Asp-OH is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA,...

Where can I buy H-bAla(2-OH,3-iBu)-Val-Val-Asp-OH?

You can request a quote for H-bAla(2-OH,3-iBu)-Val-Val-Asp-OH directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for H-bAla(2-OH,3-iBu)-Val-Val-Asp-OH?

Yes, CoreyChem provides custom synthesis services for H-bAla(2-OH,3-iBu)-Val-Val-Asp-OH and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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