![3-[(3-methoxybenzyl)sulfanyl]-5-(pyridin-3-yl)-4H-1,2,4-triazol-4-amine structure](/static/products/676/676624-96-7.png)
3-[(3-methoxybenzyl)sulfanyl]-5-(pyridin-3-yl)-4H-1,2,4-triazol-4-amine
TL;DR: 3-[(3-methoxybenzyl)sulfanyl]-5-(pyridin-3-yl)-4H-1,2,4-triazol-4-amine (CAS 676624-96-7) is a chemical compound with molecular formula C15H15N5OS and molecular weight 313.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(3-methoxyphenyl)methylsulfanyl]-5-pyridin-3-yl-1,2,4-triazol-4-amine
Also Known As: 3-((3-methoxybenzyl)thio)-5-(pyridin-3-yl)-4H-1,2,4-triazol-4-amine, 3-[(3-methoxybenzyl)sulfanyl]-5-(pyridin-3-yl)-4H-1,2,4-triazol-4-amine, 3-[(3-methoxyphenyl)methylsulfanyl]-5-pyridin-3-yl-1,2,4-triazol-4-amine
| Molecular Formula | C15H15N5OS |
|---|---|
| Molecular Weight | 313.10 g/mol |
| LogP | 2.3548 |
| Topological Polar Surface Area | 78.85 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 313.09973 |
| Heavy Atoms | 22 |
| Complexity | 759.6342 |
Chemical Identifiers
| CAS Number | 676624-96-7 |
|---|---|
| SMILES | COC1=CC=CC(=C1)CSC2=NN=C(N2N)C3=CN=CC=C3 |
Product Overview
3-[(3-methoxybenzyl)sulfanyl]-5-(pyridin-3-yl)-4H-1,2,4-triazol-4-amine (CAS 676624-96-7), with molecular formula C15H15N5OS and molecular weight 313.10 g/mol. IUPAC: 3-[(3-methoxyphenyl)methylsulfanyl]-5-pyridin-3-yl-1,2,4-triazol-4-amine.
Chemical Property Profile of 3-[(3-methoxybenzyl)sulfanyl]-5-(pyridin-3-yl)-4H-1,2,4-triazol-4-amine
Property Insights of 3-[(3-methoxybenzyl)sulfanyl]-5-(pyridin-3-yl)-4H-1,2,4-triazol-4-amine
The XLogP value of 2.3548 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[(3-methoxybenzyl)sulfanyl]-5-(pyridin-3-yl)-4H-1,2,4-triazol-4-amine. The TPSA of 78.85 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(3-methoxybenzyl)sulfanyl]-5-(pyridin-3-yl)-4H-1,2,4-triazol-4-amine. Following Lipinski's Rule of Five, 3-[(3-methoxybenzyl)sulfanyl]-5-(pyridin-3-yl)-4H-1,2,4-triazol-4-amine has 1 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-methoxybenzyl)sulfanyl]-5-(pyridin-3-yl)-4H-1,2,4-triazol-4-amine?
The CAS number of 3-[(3-methoxybenzyl)sulfanyl]-5-(pyridin-3-yl)-4H-1,2,4-triazol-4-amine is 676624-96-7.
What is the molecular formula of 3-[(3-methoxybenzyl)sulfanyl]-5-(pyridin-3-yl)-4H-1,2,4-triazol-4-amine?
The molecular formula of 3-[(3-methoxybenzyl)sulfanyl]-5-(pyridin-3-yl)-4H-1,2,4-triazol-4-amine is C15H15N5OS.
What is the molecular weight of 3-[(3-methoxybenzyl)sulfanyl]-5-(pyridin-3-yl)-4H-1,2,4-triazol-4-amine?
The molecular weight of 3-[(3-methoxybenzyl)sulfanyl]-5-(pyridin-3-yl)-4H-1,2,4-triazol-4-amine is 313.10 g/mol.
Where can I buy 3-[(3-methoxybenzyl)sulfanyl]-5-(pyridin-3-yl)-4H-1,2,4-triazol-4-amine?
You can request a quote for 3-[(3-methoxybenzyl)sulfanyl]-5-(pyridin-3-yl)-4H-1,2,4-triazol-4-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(3-methoxybenzyl)sulfanyl]-5-(pyridin-3-yl)-4H-1,2,4-triazol-4-amine?
Yes, KEHONG BIO provides custom synthesis services for 3-[(3-methoxybenzyl)sulfanyl]-5-(pyridin-3-yl)-4H-1,2,4-triazol-4-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.