3-(3,4-Diamino-5-oxo-4,5-dihydro-1,2,4-triazin-6-yl)propanoic acid
TL;DR: 3-(3,4-Diamino-5-oxo-4,5-dihydro-1,2,4-triazin-6-yl)propanoic acid (CAS 197793-89-8) is a chemical compound with molecular formula C6H9N5O3 and molecular weight 199.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3,4-diamino-5-oxo-1,2,4-triazin-6-yl)propanoic acid
Also Known As: 3-(3,4-diamino-5-oxo-4,5-dihydro-1,2,4-triazin-6-yl)propanoic acid, 3-(3,4-diamino-5-oxo-1,2,4-triazin-6-yl)propanoic Acid, 3-(3,4-diamino-5-oxo-4,5-dihydro-1,2,4-triazin-6-yl)propanoicacid
| Molecular Formula | C6H9N5O3 |
|---|---|
| Molecular Weight | 199.07 g/mol |
| LogP | -2.0485 |
| Topological Polar Surface Area | 137.12 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 199.07054 |
| Heavy Atoms | 14 |
| Complexity | 412.41827 |
Chemical Identifiers
| CAS Number | 197793-89-8 |
|---|---|
| SMILES | C(CC(=O)O)C1=NN=C(N(C1=O)N)N |
Product Overview
3-(3,4-Diamino-5-oxo-4,5-dihydro-1,2,4-triazin-6-yl)propanoic acid (CAS 197793-89-8), with molecular formula C6H9N5O3 and molecular weight 199.07 g/mol. IUPAC: 3-(3,4-diamino-5-oxo-1,2,4-triazin-6-yl)propanoic acid.
Chemical Property Profile of 3-(3,4-Diamino-5-oxo-4,5-dihydro-1,2,4-triazin-6-yl)propanoic acid
Property Insights of 3-(3,4-Diamino-5-oxo-4,5-dihydro-1,2,4-triazin-6-yl)propanoic acid
The XLogP value of -2.0485 indicates that 3-(3,4-Diamino-5-oxo-4,5-dihydro-1,2,4-triazin-6-yl)propanoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 137.12 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(3,4-Diamino-5-oxo-4,5-dihydro-1,2,4-triazin-6-yl)propanoic acid. Following Lipinski's Rule of Five, 3-(3,4-Diamino-5-oxo-4,5-dihydro-1,2,4-triazin-6-yl)propanoic acid has 3 hydrogen bond donor(s) and 6 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 3-(3,4-Diamino-5-oxo-4,5-dihydro-1,2,4-triazin-6-yl)propanoic acid?
The CAS number of 3-(3,4-Diamino-5-oxo-4,5-dihydro-1,2,4-triazin-6-yl)propanoic acid is 197793-89-8.
What is the molecular formula of 3-(3,4-Diamino-5-oxo-4,5-dihydro-1,2,4-triazin-6-yl)propanoic acid?
The molecular formula of 3-(3,4-Diamino-5-oxo-4,5-dihydro-1,2,4-triazin-6-yl)propanoic acid is C6H9N5O3.
What is the molecular weight of 3-(3,4-Diamino-5-oxo-4,5-dihydro-1,2,4-triazin-6-yl)propanoic acid?
The molecular weight of 3-(3,4-Diamino-5-oxo-4,5-dihydro-1,2,4-triazin-6-yl)propanoic acid is 199.07 g/mol.
Where can I buy 3-(3,4-Diamino-5-oxo-4,5-dihydro-1,2,4-triazin-6-yl)propanoic acid?
You can request a quote for 3-(3,4-Diamino-5-oxo-4,5-dihydro-1,2,4-triazin-6-yl)propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(3,4-Diamino-5-oxo-4,5-dihydro-1,2,4-triazin-6-yl)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(3,4-Diamino-5-oxo-4,5-dihydro-1,2,4-triazin-6-yl)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.