alpha,3-Diamino-1H-1,2,4-triazole-1-propanoic acid
TL;DR: alpha,3-Diamino-1H-1,2,4-triazole-1-propanoic acid (CAS 2990-18-3) is a chemical compound with molecular formula C5H9N5O2 and molecular weight 171.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-3-(3-amino-1,2,4-triazol-1-yl)propanoic acid
Also Known As: alpha,3-Diamino-1H-1,2,4-triazole-1-propanoic acid, 1H-1,2,4-Triazole-1-propanoic acid, alpha,3-diamino-, 2-amino-3-(3-amino-1,2,4-triazol-1-yl)propanoic acid, 3-(3-Imino-2,3-dihydro-1H-1,2,4-triazol-1-yl)alanine, 2-amino-3-(3-amino-1H-1,2,4-triazol-1-yl)propanoic acid
| Molecular Formula | C5H9N5O2 |
|---|---|
| Molecular Weight | 171.08 g/mol |
| LogP | -1.7278 |
| Topological Polar Surface Area | 120.05 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 171.07562 |
| Heavy Atoms | 12 |
| Complexity | 283.12088 |
Chemical Identifiers
| CAS Number | 2990-18-3 |
|---|---|
| SMILES | C1=NC(=NN1CC(C(=O)O)N)N |
Product Overview
alpha,3-Diamino-1H-1,2,4-triazole-1-propanoic acid (CAS 2990-18-3), with molecular formula C5H9N5O2 and molecular weight 171.08 g/mol. IUPAC: 2-amino-3-(3-amino-1,2,4-triazol-1-yl)propanoic acid.
Chemical Property Profile of alpha,3-Diamino-1H-1,2,4-triazole-1-propanoic acid
Property Insights of alpha,3-Diamino-1H-1,2,4-triazole-1-propanoic acid
The XLogP value of -1.7278 indicates that alpha,3-Diamino-1H-1,2,4-triazole-1-propanoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 120.05 Ų falls within the moderate polarity range, balancing permeability and solubility for alpha,3-Diamino-1H-1,2,4-triazole-1-propanoic acid. Following Lipinski's Rule of Five, alpha,3-Diamino-1H-1,2,4-triazole-1-propanoic acid 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,3-Diamino-1H-1,2,4-triazole-1-propanoic acid?
The CAS number of alpha,3-Diamino-1H-1,2,4-triazole-1-propanoic acid is 2990-18-3.
What is the molecular formula of alpha,3-Diamino-1H-1,2,4-triazole-1-propanoic acid?
The molecular formula of alpha,3-Diamino-1H-1,2,4-triazole-1-propanoic acid is C5H9N5O2.
What is the molecular weight of alpha,3-Diamino-1H-1,2,4-triazole-1-propanoic acid?
The molecular weight of alpha,3-Diamino-1H-1,2,4-triazole-1-propanoic acid is 171.08 g/mol.
Where can I buy alpha,3-Diamino-1H-1,2,4-triazole-1-propanoic acid?
You can request a quote for alpha,3-Diamino-1H-1,2,4-triazole-1-propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for alpha,3-Diamino-1H-1,2,4-triazole-1-propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for alpha,3-Diamino-1H-1,2,4-triazole-1-propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.