1-Methyl-L-histidine
TL;DR: 1-Methyl-L-histidine (CAS 332-80-9) 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.
(2S)-2-amino-3-(1-methylimidazol-4-yl)propanoic acid
Also Known As: 1-Methyl-L-histidine, 1-Methylhistidine, pi-methylhistidine, L-1-Methylhistidine, H-His(1-Me)-OH
| Molecular Formula | C7H11N3O2 |
|---|---|
| Molecular Weight | 169.09 g/mol |
| LogP | -3.3 |
| Topological Polar Surface Area | 81.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 169.08513 |
| Heavy Atoms | 12 |
| Complexity | 174.0 |
| Melting Point | 249 °C |
| Solubility | 200 g/kg |
Chemical Identifiers
| CAS Number | 332-80-9 |
|---|---|
| SMILES | CN1C=C(N=C1)C[C@@H](C(=O)O)N |
| InChIKey | BRMWTNUJHUMWMS-LURJTMIESA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Methyl-L-histidine (CAS 332-80-9), with molecular formula C7H11N3O2 and molecular weight 169.09 g/mol. IUPAC: (2S)-2-amino-3-(1-methylimidazol-4-yl)propanoic acid.
Chemical Property Profile of 1-Methyl-L-histidine
Property Insights of 1-Methyl-L-histidine
The XLogP value of -3.3 indicates that 1-Methyl-L-histidine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 81.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Methyl-L-histidine. Following Lipinski's Rule of Five, 1-Methyl-L-histidine has 2 hydrogen bond donor(s) and 4 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 1-Methyl-L-histidine?
The CAS number of 1-Methyl-L-histidine is 332-80-9.
What is the molecular formula of 1-Methyl-L-histidine?
The molecular formula of 1-Methyl-L-histidine is C7H11N3O2.
What is the molecular weight of 1-Methyl-L-histidine?
The molecular weight of 1-Methyl-L-histidine is 169.09 g/mol.
Where can I buy 1-Methyl-L-histidine?
You can request a quote for 1-Methyl-L-histidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methyl-L-histidine?
Yes, KEHONG BIO provides custom synthesis services for 1-Methyl-L-histidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.