Isodityrosine
TL;DR: Isodityrosine (CAS 882-23-5) is a chemical compound with molecular formula C18H20N2O6 and molecular weight 360.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-amino-3-[4-[5-(2-amino-2-carboxyethyl)-2-hydroxyphenoxy]phenyl]propanoic acid
Also Known As: Isodityrosine, KST-1A8708, L-Tyrosine, O-(5-(2-amino-2-carboxyethyl)-2-hydroxyphenyl)-, L-Tyrosine, O-[5-(2-amino-2-carboxyethyl)-2-hydroxyphenyl]-, (2S)-2-amino-3-[4-[5-(2-amino-2-carboxyethyl)-2-hydroxyphenoxy]phenyl]propanoic acid
| Molecular Formula | C18H20N2O6 |
|---|---|
| Molecular Weight | 360.13 g/mol |
| LogP | -3.6 |
| Topological Polar Surface Area | 156.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 360.13214 |
| Heavy Atoms | 26 |
| Complexity | 480.0 |
Chemical Identifiers
| CAS Number | 882-23-5 |
|---|---|
| SMILES | C1=CC(=CC=C1C[C@@H](C(=O)O)N)OC2=C(C=CC(=C2)CC(C(=O)O)N)O |
| InChIKey | FWZXNPNHUWFOCM-LSLKUGRBSA-N |
Product Overview
Isodityrosine (CAS 882-23-5), with molecular formula C18H20N2O6 and molecular weight 360.13 g/mol. IUPAC: (2S)-2-amino-3-[4-[5-(2-amino-2-carboxyethyl)-2-hydroxyphenoxy]phenyl]propanoic acid.
Chemical Property Profile of Isodityrosine
Property Insights of Isodityrosine
The XLogP value of -3.6 indicates that Isodityrosine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 156.0 Ų indicates high polarity, suggesting Isodityrosine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Isodityrosine has 5 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Isodityrosine?
The CAS number of Isodityrosine is 882-23-5.
What is the molecular formula of Isodityrosine?
The molecular formula of Isodityrosine is C18H20N2O6.
What is the molecular weight of Isodityrosine?
The molecular weight of Isodityrosine is 360.13 g/mol.
Where can I buy Isodityrosine?
You can request a quote for Isodityrosine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isodityrosine?
Yes, KEHONG BIO provides custom synthesis services for Isodityrosine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.