4-Hydroxybestatin
TL;DR: 4-Hydroxybestatin (CAS 66413-44-3) is a chemical compound with molecular formula C16H24N2O5 and molecular weight 324.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-[[3-amino-2-hydroxy-4-(4-hydroxyphenyl)butanoyl]amino]-4-methylpentanoic acid
Also Known As: 4-Hydroxybestatin, (2S)-2-[[3-amino-2-hydroxy-4-(4-hydroxyphenyl)butanoyl]amino]-4-methylpentanoic acid, (3-amino-2-hydroxy-4-(4-hydroxyphenyl)butanoyl)-L-leucine, L-Leucine, N-(3-amino-2-hydroxy-4-(4-hydroxyphenyl)-1-oxobutyl)-, (2S)-2-[[3-amino-2-hydroxy-4-(4-hydroxyphenyl)butanoyl]amino]-4-methyl-pentanoic acid
| Molecular Formula | C16H24N2O5 |
|---|---|
| Molecular Weight | 324.17 g/mol |
| LogP | 0.2384 |
| Topological Polar Surface Area | 132.88 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 324.16852 |
| Heavy Atoms | 23 |
| Complexity | 529.77704 |
Chemical Identifiers
| CAS Number | 66413-44-3 |
|---|---|
| SMILES | CC(C)C[C@@H](C(=O)O)NC(=O)C(C(CC1=CC=C(C=C1)O)N)O |
Product Overview
4-Hydroxybestatin (CAS 66413-44-3), with molecular formula C16H24N2O5 and molecular weight 324.17 g/mol. IUPAC: (2S)-2-[[3-amino-2-hydroxy-4-(4-hydroxyphenyl)butanoyl]amino]-4-methylpentanoic acid.
Chemical Property Profile of 4-Hydroxybestatin
Property Insights of 4-Hydroxybestatin
The XLogP value of 0.2384 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Hydroxybestatin. The TPSA of 132.88 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Hydroxybestatin. Following Lipinski's Rule of Five, 4-Hydroxybestatin has 5 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 4-Hydroxybestatin?
The CAS number of 4-Hydroxybestatin is 66413-44-3.
What is the molecular formula of 4-Hydroxybestatin?
The molecular formula of 4-Hydroxybestatin is C16H24N2O5.
What is the molecular weight of 4-Hydroxybestatin?
The molecular weight of 4-Hydroxybestatin is 324.17 g/mol.
Where can I buy 4-Hydroxybestatin?
You can request a quote for 4-Hydroxybestatin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Hydroxybestatin?
Yes, KEHONG BIO provides custom synthesis services for 4-Hydroxybestatin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.