![2-[(2-Amino-3-hydroxybutanoyl)amino]-3-methylbutanoic acid structure](/static/products/5616/5616-75-1.webp)
2-[(2-Amino-3-hydroxybutanoyl)amino]-3-methylbutanoic acid
TL;DR: 2-[(2-Amino-3-hydroxybutanoyl)amino]-3-methylbutanoic acid (CAS 5616-75-1) is a chemical compound with molecular formula C9H18N2O4 and molecular weight 218.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2-amino-3-hydroxybutanoyl)amino]-3-methylbutanoic acid
Also Known As: Threonylvaline, Threoninyl-Valine, Thr-Val, H-Thr-Val-OH, L-Valine, L-threonyl-
| Molecular Formula | C9H18N2O4 |
|---|---|
| Molecular Weight | 218.13 g/mol |
| LogP | -3.0 |
| Topological Polar Surface Area | 113.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 218.12666 |
| Heavy Atoms | 15 |
| Complexity | 242.0 |
Chemical Identifiers
| CAS Number | 5616-75-1 |
|---|---|
| SMILES | CC(C)C(C(=O)O)NC(=O)C(C(C)O)N |
| InChIKey | CKHWEVXPLJBEOZ-UHFFFAOYSA-N |
Product Overview
2-[(2-Amino-3-hydroxybutanoyl)amino]-3-methylbutanoic acid (CAS 5616-75-1), with molecular formula C9H18N2O4 and molecular weight 218.13 g/mol. IUPAC: 2-[(2-amino-3-hydroxybutanoyl)amino]-3-methylbutanoic acid.
Chemical Property Profile of 2-[(2-Amino-3-hydroxybutanoyl)amino]-3-methylbutanoic acid
Property Insights of 2-[(2-Amino-3-hydroxybutanoyl)amino]-3-methylbutanoic acid
The XLogP value of -3.0 indicates that 2-[(2-Amino-3-hydroxybutanoyl)amino]-3-methylbutanoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 113.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(2-Amino-3-hydroxybutanoyl)amino]-3-methylbutanoic acid. Following Lipinski's Rule of Five, 2-[(2-Amino-3-hydroxybutanoyl)amino]-3-methylbutanoic acid has 4 hydrogen bond donor(s) and 5 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 2-[(2-Amino-3-hydroxybutanoyl)amino]-3-methylbutanoic acid?
The CAS number of 2-[(2-Amino-3-hydroxybutanoyl)amino]-3-methylbutanoic acid is 5616-75-1.
What is the molecular formula of 2-[(2-Amino-3-hydroxybutanoyl)amino]-3-methylbutanoic acid?
The molecular formula of 2-[(2-Amino-3-hydroxybutanoyl)amino]-3-methylbutanoic acid is C9H18N2O4.
What is the molecular weight of 2-[(2-Amino-3-hydroxybutanoyl)amino]-3-methylbutanoic acid?
The molecular weight of 2-[(2-Amino-3-hydroxybutanoyl)amino]-3-methylbutanoic acid is 218.13 g/mol.
Where can I buy 2-[(2-Amino-3-hydroxybutanoyl)amino]-3-methylbutanoic acid?
You can request a quote for 2-[(2-Amino-3-hydroxybutanoyl)amino]-3-methylbutanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(2-Amino-3-hydroxybutanoyl)amino]-3-methylbutanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[(2-Amino-3-hydroxybutanoyl)amino]-3-methylbutanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.