5-dodecylthio-1H-1,2,4-triazole-3-ylamine
TL;DR: 5-dodecylthio-1H-1,2,4-triazole-3-ylamine (CAS 147698-61-1) is a chemical compound with molecular formula C14H28N4S and molecular weight 284.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-dodecylsulfanyl-1H-1,2,4-triazol-5-amine
Also Known As: 3-dodecylsulfanyl-1H-1,2,4-triazol-5-amine, 5-dodecylsulfanyl-2H-1,2,4-triazol-3-amine, 5-dodecylthio-1H-1,2,4-triazole-3-ylamine, 5-Dodecylsulfanyl-4H-[1,2,4]triazol-3-ylamine
| Molecular Formula | C14H28N4S |
|---|---|
| Molecular Weight | 284.20 g/mol |
| LogP | 4.3999 |
| Topological Polar Surface Area | 67.59 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 12 |
| Exact Mass | 284.20346 |
| Heavy Atoms | 19 |
| Complexity | 314.14954 |
Chemical Identifiers
| CAS Number | 147698-61-1 |
|---|---|
| SMILES | CCCCCCCCCCCCSC1=NNC(=N1)N |
Product Overview
5-dodecylthio-1H-1,2,4-triazole-3-ylamine (CAS 147698-61-1), with molecular formula C14H28N4S and molecular weight 284.20 g/mol. IUPAC: 3-dodecylsulfanyl-1H-1,2,4-triazol-5-amine.
Chemical Property Profile of 5-dodecylthio-1H-1,2,4-triazole-3-ylamine
Property Insights of 5-dodecylthio-1H-1,2,4-triazole-3-ylamine
The XLogP value of 4.3999 indicates that 5-dodecylthio-1H-1,2,4-triazole-3-ylamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.59 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-dodecylthio-1H-1,2,4-triazole-3-ylamine. Following Lipinski's Rule of Five, 5-dodecylthio-1H-1,2,4-triazole-3-ylamine has 2 hydrogen bond donor(s) and 4 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 5-dodecylthio-1H-1,2,4-triazole-3-ylamine?
The CAS number of 5-dodecylthio-1H-1,2,4-triazole-3-ylamine is 147698-61-1.
What is the molecular formula of 5-dodecylthio-1H-1,2,4-triazole-3-ylamine?
The molecular formula of 5-dodecylthio-1H-1,2,4-triazole-3-ylamine is C14H28N4S.
What is the molecular weight of 5-dodecylthio-1H-1,2,4-triazole-3-ylamine?
The molecular weight of 5-dodecylthio-1H-1,2,4-triazole-3-ylamine is 284.20 g/mol.
Where can I buy 5-dodecylthio-1H-1,2,4-triazole-3-ylamine?
You can request a quote for 5-dodecylthio-1H-1,2,4-triazole-3-ylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-dodecylthio-1H-1,2,4-triazole-3-ylamine?
Yes, KEHONG BIO provides custom synthesis services for 5-dodecylthio-1H-1,2,4-triazole-3-ylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.