(2S)-2-((3,5-Dimethyl-1,2-oxazol-4-yl)amino)propanoic acid
TL;DR: (2S)-2-((3,5-Dimethyl-1,2-oxazol-4-yl)amino)propanoic acid (CAS 98166-05-3) is a chemical compound with molecular formula C8H12N2O3 and molecular weight 184.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-[(3,5-dimethyl-1,2-oxazol-4-yl)amino]propanoic acid
Also Known As: L-Alanine, N-(3,5-dimethyl-4-isoxazolyl)-, N-(3,5-Dimethyl-1,2-oxazol-4-yl)alanine, N-(3,5-dimethyl-1,2-oxazol-4-yl)-L-alanine, (2S)-2-((3,5-Dimethyl-1,2-oxazol-4-yl)amino)propanoic acid, (2S)-2-[(3,5-dimethyl-1,2-oxazol-4-yl)amino]propanoic Acid
| Molecular Formula | C8H12N2O3 |
|---|---|
| Molecular Weight | 184.08 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 75.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 184.0848 |
| Heavy Atoms | 13 |
| Complexity | 198.0 |
Chemical Identifiers
| CAS Number | 98166-05-3 |
|---|---|
| SMILES | CC1=C(C(=NO1)C)N[C@@H](C)C(=O)O |
| InChIKey | XYHVNOTXFLCWOZ-YFKPBYRVSA-N |
Product Overview
(2S)-2-((3,5-Dimethyl-1,2-oxazol-4-yl)amino)propanoic acid (CAS 98166-05-3), with molecular formula C8H12N2O3 and molecular weight 184.08 g/mol. IUPAC: (2S)-2-[(3,5-dimethyl-1,2-oxazol-4-yl)amino]propanoic acid.
Chemical Property Profile of (2S)-2-((3,5-Dimethyl-1,2-oxazol-4-yl)amino)propanoic acid
Property Insights of (2S)-2-((3,5-Dimethyl-1,2-oxazol-4-yl)amino)propanoic acid
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2S)-2-((3,5-Dimethyl-1,2-oxazol-4-yl)amino)propanoic acid. The TPSA of 75.4 Ų falls within the moderate polarity range, balancing permeability and solubility for (2S)-2-((3,5-Dimethyl-1,2-oxazol-4-yl)amino)propanoic acid. Following Lipinski's Rule of Five, (2S)-2-((3,5-Dimethyl-1,2-oxazol-4-yl)amino)propanoic acid has 2 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 (2S)-2-((3,5-Dimethyl-1,2-oxazol-4-yl)amino)propanoic acid?
The CAS number of (2S)-2-((3,5-Dimethyl-1,2-oxazol-4-yl)amino)propanoic acid is 98166-05-3.
What is the molecular formula of (2S)-2-((3,5-Dimethyl-1,2-oxazol-4-yl)amino)propanoic acid?
The molecular formula of (2S)-2-((3,5-Dimethyl-1,2-oxazol-4-yl)amino)propanoic acid is C8H12N2O3.
What is the molecular weight of (2S)-2-((3,5-Dimethyl-1,2-oxazol-4-yl)amino)propanoic acid?
The molecular weight of (2S)-2-((3,5-Dimethyl-1,2-oxazol-4-yl)amino)propanoic acid is 184.08 g/mol.
Where can I buy (2S)-2-((3,5-Dimethyl-1,2-oxazol-4-yl)amino)propanoic acid?
You can request a quote for (2S)-2-((3,5-Dimethyl-1,2-oxazol-4-yl)amino)propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2S)-2-((3,5-Dimethyl-1,2-oxazol-4-yl)amino)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (2S)-2-((3,5-Dimethyl-1,2-oxazol-4-yl)amino)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.