![3-[(3-methoxyphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-amine structure](/static/products/861/861925-36-2.png)
3-[(3-methoxyphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-amine
TL;DR: 3-[(3-methoxyphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-amine (CAS 861925-36-2) is a chemical compound with molecular formula C10H12N4OS and molecular weight 236.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(3-methoxyphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-amine
Also Known As: 3-[(3-methoxyphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-amine, 5-(3-Methoxy-benzylsulfanyl)-1H-[1,2,4]triazol-3-ylamine
| Molecular Formula | C10H12N4OS |
|---|---|
| Molecular Weight | 236.07 g/mol |
| LogP | 1.6878 |
| Topological Polar Surface Area | 76.82 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 236.07318 |
| Heavy Atoms | 16 |
| Complexity | 471.3475 |
Chemical Identifiers
| CAS Number | 861925-36-2 |
|---|---|
| SMILES | COC1=CC=CC(=C1)CSC2=NNC(=N2)N |
Product Overview
3-[(3-methoxyphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-amine (CAS 861925-36-2), with molecular formula C10H12N4OS and molecular weight 236.07 g/mol. IUPAC: 3-[(3-methoxyphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-amine.
Chemical Property Profile of 3-[(3-methoxyphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-amine
Property Insights of 3-[(3-methoxyphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-amine
The XLogP value of 1.6878 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[(3-methoxyphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-amine. The TPSA of 76.82 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(3-methoxyphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-amine. Following Lipinski's Rule of Five, 3-[(3-methoxyphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-amine has 2 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 3-[(3-methoxyphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-amine?
The CAS number of 3-[(3-methoxyphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-amine is 861925-36-2.
What is the molecular formula of 3-[(3-methoxyphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-amine?
The molecular formula of 3-[(3-methoxyphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-amine is C10H12N4OS.
What is the molecular weight of 3-[(3-methoxyphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-amine?
The molecular weight of 3-[(3-methoxyphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-amine is 236.07 g/mol.
Where can I buy 3-[(3-methoxyphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-amine?
You can request a quote for 3-[(3-methoxyphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-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-methoxyphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-amine?
Yes, KEHONG BIO provides custom synthesis services for 3-[(3-methoxyphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.