Fludalanine
TL;DR: Fludalanine (CAS 97613-64-4) is a chemical compound with molecular formula C3H6FNO2 and molecular weight 108.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-amino-2-deuterio-3-fluoropropanoic acid
Also Known As: FLUDALANINE, Fludalanina, Fludalaninum, 3-Fluoro-D-alanine-2-d, 3-Fluoro-D-alanine
| Molecular Formula | C3H6FNO2 |
|---|---|
| Molecular Weight | 108.04 g/mol |
| LogP | -3.0 |
| Topological Polar Surface Area | 63.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 108.04453 |
| Heavy Atoms | 7 |
| Complexity | 75.0 |
Chemical Identifiers
| CAS Number | 97613-64-4 |
|---|---|
| SMILES | [2H][C@@](CF)(C(=O)O)N |
| InChIKey | UYTSRQMXRROFPU-LIIDHCAMSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Fludalanine (CAS 97613-64-4), with molecular formula C3H6FNO2 and molecular weight 108.04 g/mol. IUPAC: (2S)-2-amino-2-deuterio-3-fluoropropanoic acid.
Chemical Property Profile of Fludalanine
Property Insights of Fludalanine
The XLogP value of -3.0 indicates that Fludalanine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 63.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Fludalanine. Following Lipinski's Rule of Five, Fludalanine 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 Fludalanine?
The CAS number of Fludalanine is 97613-64-4.
What is the molecular formula of Fludalanine?
The molecular formula of Fludalanine is C3H6FNO2.
What is the molecular weight of Fludalanine?
The molecular weight of Fludalanine is 108.04 g/mol.
Where can I buy Fludalanine?
You can request a quote for Fludalanine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Fludalanine?
Yes, KEHONG BIO provides custom synthesis services for Fludalanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.