beta-(1,2,4-triazol-3-yl)-L-alanine
TL;DR: beta-(1,2,4-triazol-3-yl)-L-alanine (CAS 4819-36-7) is a chemical compound with molecular formula C5H8N4O2 and molecular weight 156.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-azaniumyl-3-(1,2,4-triazol-1-yl)propanoate
Also Known As: 3-(1,2,4-Triazol-1-yl)-L-alanine, beta-(1,2,4-triazol-3-yl)-L-alanine
| Molecular Formula | C5H8N4O2 |
|---|---|
| Molecular Weight | 156.06 g/mol |
| LogP | -3.3615 |
| Topological Polar Surface Area | 98.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 156.06473 |
| Heavy Atoms | 11 |
| Complexity | 232.64027 |
Chemical Identifiers
| CAS Number | 4819-36-7 |
|---|---|
| SMILES | C1=NN(C=N1)C[C@@H](C(=O)[O-])[NH3+] |
Product Overview
beta-(1,2,4-triazol-3-yl)-L-alanine (CAS 4819-36-7), with molecular formula C5H8N4O2 and molecular weight 156.06 g/mol. IUPAC: (2S)-2-azaniumyl-3-(1,2,4-triazol-1-yl)propanoate.
Chemical Property Profile of beta-(1,2,4-triazol-3-yl)-L-alanine
Property Insights of beta-(1,2,4-triazol-3-yl)-L-alanine
The XLogP value of -3.3615 indicates that beta-(1,2,4-triazol-3-yl)-L-alanine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 98.48 Ų falls within the moderate polarity range, balancing permeability and solubility for beta-(1,2,4-triazol-3-yl)-L-alanine. Following Lipinski's Rule of Five, beta-(1,2,4-triazol-3-yl)-L-alanine has 1 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 beta-(1,2,4-triazol-3-yl)-L-alanine?
The CAS number of beta-(1,2,4-triazol-3-yl)-L-alanine is 4819-36-7.
What is the molecular formula of beta-(1,2,4-triazol-3-yl)-L-alanine?
The molecular formula of beta-(1,2,4-triazol-3-yl)-L-alanine is C5H8N4O2.
What is the molecular weight of beta-(1,2,4-triazol-3-yl)-L-alanine?
The molecular weight of beta-(1,2,4-triazol-3-yl)-L-alanine is 156.06 g/mol.
Where can I buy beta-(1,2,4-triazol-3-yl)-L-alanine?
You can request a quote for beta-(1,2,4-triazol-3-yl)-L-alanine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for beta-(1,2,4-triazol-3-yl)-L-alanine?
Yes, KEHONG BIO provides custom synthesis services for beta-(1,2,4-triazol-3-yl)-L-alanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.