2-(4-Amino-5-(4-pyridyl)-1,2,4-triazol-3-ylthio)acetic acid
TL;DR: 2-(4-Amino-5-(4-pyridyl)-1,2,4-triazol-3-ylthio)acetic acid (CAS 150536-07-5) is a chemical compound with molecular formula C9H9N5O2S and molecular weight 251.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-amino-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetic acid
Also Known As: 2-(4-amino-5-(4-pyridyl)-1,2,4-triazol-3-ylthio)acetic acid, 2-[(4-amino-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetic Acid, 2-{[4-AMINO-5-(PYRIDIN-4-YL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL}ACETIC ACID, 2-((4-amino-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl)thio)acetic acid, 2-[[5-(4-Pyridyl)-4-amino-4H-1,2,4-triazol-3-yl]thio]acetic acid
| Molecular Formula | C9H9N5O2S |
|---|---|
| Molecular Weight | 251.05 g/mol |
| LogP | 0.2306 |
| Topological Polar Surface Area | 106.92 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 251.0477 |
| Heavy Atoms | 17 |
| Complexity | 527.43744 |
Chemical Identifiers
| CAS Number | 150536-07-5 |
|---|---|
| SMILES | C1=CN=CC=C1C2=NN=C(N2N)SCC(=O)O |
Product Overview
2-(4-Amino-5-(4-pyridyl)-1,2,4-triazol-3-ylthio)acetic acid (CAS 150536-07-5), with molecular formula C9H9N5O2S and molecular weight 251.05 g/mol. IUPAC: 2-[(4-amino-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetic acid.
Chemical Property Profile of 2-(4-Amino-5-(4-pyridyl)-1,2,4-triazol-3-ylthio)acetic acid
Property Insights of 2-(4-Amino-5-(4-pyridyl)-1,2,4-triazol-3-ylthio)acetic acid
The XLogP value of 0.2306 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Amino-5-(4-pyridyl)-1,2,4-triazol-3-ylthio)acetic acid. The TPSA of 106.92 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-Amino-5-(4-pyridyl)-1,2,4-triazol-3-ylthio)acetic acid. Following Lipinski's Rule of Five, 2-(4-Amino-5-(4-pyridyl)-1,2,4-triazol-3-ylthio)acetic acid has 2 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 2-(4-Amino-5-(4-pyridyl)-1,2,4-triazol-3-ylthio)acetic acid?
The CAS number of 2-(4-Amino-5-(4-pyridyl)-1,2,4-triazol-3-ylthio)acetic acid is 150536-07-5.
What is the molecular formula of 2-(4-Amino-5-(4-pyridyl)-1,2,4-triazol-3-ylthio)acetic acid?
The molecular formula of 2-(4-Amino-5-(4-pyridyl)-1,2,4-triazol-3-ylthio)acetic acid is C9H9N5O2S.
What is the molecular weight of 2-(4-Amino-5-(4-pyridyl)-1,2,4-triazol-3-ylthio)acetic acid?
The molecular weight of 2-(4-Amino-5-(4-pyridyl)-1,2,4-triazol-3-ylthio)acetic acid is 251.05 g/mol.
Where can I buy 2-(4-Amino-5-(4-pyridyl)-1,2,4-triazol-3-ylthio)acetic acid?
You can request a quote for 2-(4-Amino-5-(4-pyridyl)-1,2,4-triazol-3-ylthio)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Amino-5-(4-pyridyl)-1,2,4-triazol-3-ylthio)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Amino-5-(4-pyridyl)-1,2,4-triazol-3-ylthio)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.