2-amino-3-(1H-imidazol-5-yl)-2-methylpropanoic acid
TL;DR: 2-amino-3-(1H-imidazol-5-yl)-2-methylpropanoic acid (CAS 587-20-2) is a chemical compound with molecular formula C7H11N3O2 and molecular weight 169.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-3-(1H-imidazol-5-yl)-2-methylpropanoic acid
Also Known As: alpha-Methylhistidine, alpha-methylhistadine, alpha-METHYL-DL-HISTIDINE, 2-amino-3-(1H-imidazol-5-yl)-2-methylpropanoic acid, 2-Amino-3-(1H-imidazol-4-yl)-2-methylpropanoic acid
| Molecular Formula | C7H11N3O2 |
|---|---|
| Molecular Weight | 169.09 g/mol |
| LogP | -0.2458 |
| Topological Polar Surface Area | 92.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 169.08513 |
| Heavy Atoms | 12 |
| Complexity | 266.18866 |
Chemical Identifiers
| CAS Number | 587-20-2 |
|---|---|
| SMILES | CC(CC1=CN=CN1)(C(=O)O)N |
Product Overview
2-amino-3-(1H-imidazol-5-yl)-2-methylpropanoic acid (CAS 587-20-2), with molecular formula C7H11N3O2 and molecular weight 169.09 g/mol. IUPAC: 2-amino-3-(1H-imidazol-5-yl)-2-methylpropanoic acid.
Chemical Property Profile of 2-amino-3-(1H-imidazol-5-yl)-2-methylpropanoic acid
Property Insights of 2-amino-3-(1H-imidazol-5-yl)-2-methylpropanoic acid
The XLogP value of -0.2458 indicates that 2-amino-3-(1H-imidazol-5-yl)-2-methylpropanoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 92.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-amino-3-(1H-imidazol-5-yl)-2-methylpropanoic acid. Following Lipinski's Rule of Five, 2-amino-3-(1H-imidazol-5-yl)-2-methylpropanoic acid has 3 hydrogen bond donor(s) and 3 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-amino-3-(1H-imidazol-5-yl)-2-methylpropanoic acid?
The CAS number of 2-amino-3-(1H-imidazol-5-yl)-2-methylpropanoic acid is 587-20-2.
What is the molecular formula of 2-amino-3-(1H-imidazol-5-yl)-2-methylpropanoic acid?
The molecular formula of 2-amino-3-(1H-imidazol-5-yl)-2-methylpropanoic acid is C7H11N3O2.
What is the molecular weight of 2-amino-3-(1H-imidazol-5-yl)-2-methylpropanoic acid?
The molecular weight of 2-amino-3-(1H-imidazol-5-yl)-2-methylpropanoic acid is 169.09 g/mol.
Where can I buy 2-amino-3-(1H-imidazol-5-yl)-2-methylpropanoic acid?
You can request a quote for 2-amino-3-(1H-imidazol-5-yl)-2-methylpropanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-amino-3-(1H-imidazol-5-yl)-2-methylpropanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-amino-3-(1H-imidazol-5-yl)-2-methylpropanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.