alpha-Fluoromethylhistidine, (S)-
TL;DR: alpha-Fluoromethylhistidine, (S)- (CAS 966-89-2) is a chemical compound with molecular formula C7H10FN3O2 and molecular weight 187.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-amino-2-(fluoromethyl)-3-(1H-imidazol-5-yl)propanoic acid
Also Known As: alpha-Fluoromethylhistidine, (s)-alpha-fluoromethylhistidine, A-(fluoromethyl)-l-histidine, L-Histidine, alpha-(fluoromethyl)-, ALPHA-FMH, (S)-
| Molecular Formula | C7H10FN3O2 |
|---|---|
| Molecular Weight | 187.08 g/mol |
| LogP | -3.1 |
| Topological Polar Surface Area | 92.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 187.0757 |
| Heavy Atoms | 13 |
| Complexity | 202.0 |
Chemical Identifiers
| CAS Number | 966-89-2 |
|---|---|
| SMILES | C1=C(NC=N1)C[C@@](CF)(C(=O)O)N |
| InChIKey | AJFGLTPLWPTALJ-SSDOTTSWSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
alpha-Fluoromethylhistidine, (S)- (CAS 966-89-2), with molecular formula C7H10FN3O2 and molecular weight 187.08 g/mol. IUPAC: (2S)-2-amino-2-(fluoromethyl)-3-(1H-imidazol-5-yl)propanoic acid.
Chemical Property Profile of alpha-Fluoromethylhistidine, (S)-
Property Insights of alpha-Fluoromethylhistidine, (S)-
The XLogP value of -3.1 indicates that alpha-Fluoromethylhistidine, (S)- 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 alpha-Fluoromethylhistidine, (S)-. Following Lipinski's Rule of Five, alpha-Fluoromethylhistidine, (S)- has 3 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 alpha-Fluoromethylhistidine, (S)-?
The CAS number of alpha-Fluoromethylhistidine, (S)- is 966-89-2.
What is the molecular formula of alpha-Fluoromethylhistidine, (S)-?
The molecular formula of alpha-Fluoromethylhistidine, (S)- is C7H10FN3O2.
What is the molecular weight of alpha-Fluoromethylhistidine, (S)-?
The molecular weight of alpha-Fluoromethylhistidine, (S)- is 187.08 g/mol.
Where can I buy alpha-Fluoromethylhistidine, (S)-?
You can request a quote for alpha-Fluoromethylhistidine, (S)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for alpha-Fluoromethylhistidine, (S)-?
Yes, KEHONG BIO provides custom synthesis services for alpha-Fluoromethylhistidine, (S)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.