Threonyl-aspartyl-tyrosine
TL;DR: Threonyl-aspartyl-tyrosine (CAS 115053-54-8) is a chemical compound with molecular formula C17H23N3O8 and molecular weight 397.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-amino-4-[6-(2-amino-2-carboxyethyl)-2-(2-amino-3-hydroxybutanoyl)-3-hydroxyphenyl]-4-oxobutanoic acid
Also Known As: Thr-asp-tyr, lysozyme peptide, Threonyl-aspartyl-tyrosine, Spa-S-646, N-(N-L-Threonyl-L-alpha-aspartyl)-L-tyrosine
| Molecular Formula | C17H23N3O8 |
|---|---|
| Molecular Weight | 397.15 g/mol |
| LogP | -1.7779 |
| Topological Polar Surface Area | 227.26 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 10 |
| Exact Mass | 397.14853 |
| Heavy Atoms | 28 |
| Complexity | 792.85236 |
Chemical Identifiers
| CAS Number | 115053-54-8 |
|---|---|
| SMILES | CC(C(C(=O)C1=C(C=CC(=C1C(=O)C(CC(=O)O)N)CC(C(=O)O)N)O)N)O |
Product Overview
Threonyl-aspartyl-tyrosine (CAS 115053-54-8), with molecular formula C17H23N3O8 and molecular weight 397.15 g/mol. IUPAC: 3-amino-4-[6-(2-amino-2-carboxyethyl)-2-(2-amino-3-hydroxybutanoyl)-3-hydroxyphenyl]-4-oxobutanoic acid.
Chemical Property Profile of Threonyl-aspartyl-tyrosine
Property Insights of Threonyl-aspartyl-tyrosine
The XLogP value of -1.7779 indicates that Threonyl-aspartyl-tyrosine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 227.26 Ų indicates high polarity, suggesting Threonyl-aspartyl-tyrosine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Threonyl-aspartyl-tyrosine has 7 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Threonyl-aspartyl-tyrosine?
The CAS number of Threonyl-aspartyl-tyrosine is 115053-54-8.
What is the molecular formula of Threonyl-aspartyl-tyrosine?
The molecular formula of Threonyl-aspartyl-tyrosine is C17H23N3O8.
What is the molecular weight of Threonyl-aspartyl-tyrosine?
The molecular weight of Threonyl-aspartyl-tyrosine is 397.15 g/mol.
Where can I buy Threonyl-aspartyl-tyrosine?
You can request a quote for Threonyl-aspartyl-tyrosine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Threonyl-aspartyl-tyrosine?
Yes, KEHONG BIO provides custom synthesis services for Threonyl-aspartyl-tyrosine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.