beta-Aspartylhistidine
TL;DR: beta-Aspartylhistidine (CAS 3790-53-2) is a chemical compound with molecular formula C10H14N4O5 and molecular weight 270.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-4-[[1-carboxy-2-(1H-imidazol-5-yl)ethyl]amino]-4-oxobutanoic acid
Also Known As: beta-Aspartylhistidine, H-ASP(HIS-OH)-OH, Histidine, I(2)-aspartyl-, 2-amino-4-[[1-hydroxy-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]amino]-4-oxobutanoic acid, BDH
| Molecular Formula | C10H14N4O5 |
|---|---|
| Molecular Weight | 270.10 g/mol |
| LogP | -1.6764 |
| Topological Polar Surface Area | 158.4 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 270.0964 |
| Heavy Atoms | 19 |
| Complexity | 458.49487 |
Chemical Identifiers
| CAS Number | 3790-53-2 |
|---|---|
| SMILES | C1=C(NC=N1)CC(C(=O)O)NC(=O)CC(C(=O)O)N |
Product Overview
beta-Aspartylhistidine (CAS 3790-53-2), with molecular formula C10H14N4O5 and molecular weight 270.10 g/mol. IUPAC: 2-amino-4-[[1-carboxy-2-(1H-imidazol-5-yl)ethyl]amino]-4-oxobutanoic acid.
Chemical Property Profile of beta-Aspartylhistidine
Property Insights of beta-Aspartylhistidine
The XLogP value of -1.6764 indicates that beta-Aspartylhistidine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 158.4 Ų indicates high polarity, suggesting beta-Aspartylhistidine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, beta-Aspartylhistidine 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 beta-Aspartylhistidine?
The CAS number of beta-Aspartylhistidine is 3790-53-2.
What is the molecular formula of beta-Aspartylhistidine?
The molecular formula of beta-Aspartylhistidine is C10H14N4O5.
What is the molecular weight of beta-Aspartylhistidine?
The molecular weight of beta-Aspartylhistidine is 270.10 g/mol.
Where can I buy beta-Aspartylhistidine?
You can request a quote for beta-Aspartylhistidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for beta-Aspartylhistidine?
Yes, KEHONG BIO provides custom synthesis services for beta-Aspartylhistidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.