3-propyl-5-(propylsulfanyl)-4H-1,2,4-triazol-4-amine
TL;DR: 3-propyl-5-(propylsulfanyl)-4H-1,2,4-triazol-4-amine (CAS 449746-06-9) is a chemical compound with molecular formula C8H16N4S and molecular weight 200.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-propyl-5-propylsulfanyl-1,2,4-triazol-4-amine
Also Known As: 3-propyl-5-(propylsulfanyl)-4H-1,2,4-triazol-4-amine, 3-Propyl-5-propylsulfanyl-[1,2,4]triazol-4-ylamine, 3-propyl-5-propylsulfanyl-1,2,4-triazol-4-amine, 3-Propyl-5-(propylthio)-4H-1,2,4-triazol-4-amine, 5-propyl-3-propylthio-1,2,4-triazole-4-ylamine
| Molecular Formula | C8H16N4S |
|---|---|
| Molecular Weight | 200.11 g/mol |
| LogP | 1.4465 |
| Topological Polar Surface Area | 56.73 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 200.10957 |
| Heavy Atoms | 13 |
| Complexity | 258.64676 |
Chemical Identifiers
| CAS Number | 449746-06-9 |
|---|---|
| SMILES | CCCC1=NN=C(N1N)SCCC |
Product Overview
3-propyl-5-(propylsulfanyl)-4H-1,2,4-triazol-4-amine (CAS 449746-06-9), with molecular formula C8H16N4S and molecular weight 200.11 g/mol. IUPAC: 3-propyl-5-propylsulfanyl-1,2,4-triazol-4-amine.
Chemical Property Profile of 3-propyl-5-(propylsulfanyl)-4H-1,2,4-triazol-4-amine
Property Insights of 3-propyl-5-(propylsulfanyl)-4H-1,2,4-triazol-4-amine
The XLogP value of 1.4465 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-propyl-5-(propylsulfanyl)-4H-1,2,4-triazol-4-amine. With a topological polar surface area (TPSA) of 56.73 Ų, 3-propyl-5-(propylsulfanyl)-4H-1,2,4-triazol-4-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-propyl-5-(propylsulfanyl)-4H-1,2,4-triazol-4-amine has 1 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 3-propyl-5-(propylsulfanyl)-4H-1,2,4-triazol-4-amine?
The CAS number of 3-propyl-5-(propylsulfanyl)-4H-1,2,4-triazol-4-amine is 449746-06-9.
What is the molecular formula of 3-propyl-5-(propylsulfanyl)-4H-1,2,4-triazol-4-amine?
The molecular formula of 3-propyl-5-(propylsulfanyl)-4H-1,2,4-triazol-4-amine is C8H16N4S.
What is the molecular weight of 3-propyl-5-(propylsulfanyl)-4H-1,2,4-triazol-4-amine?
The molecular weight of 3-propyl-5-(propylsulfanyl)-4H-1,2,4-triazol-4-amine is 200.11 g/mol.
Where can I buy 3-propyl-5-(propylsulfanyl)-4H-1,2,4-triazol-4-amine?
You can request a quote for 3-propyl-5-(propylsulfanyl)-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-propyl-5-(propylsulfanyl)-4H-1,2,4-triazol-4-amine?
Yes, KEHONG BIO provides custom synthesis services for 3-propyl-5-(propylsulfanyl)-4H-1,2,4-triazol-4-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.