![3-Heptylsulfanyl-[1,2,4]thiadiazol-5-ylamine structure](/static/products/2155/215593-27-4.webp)
3-Heptylsulfanyl-[1,2,4]thiadiazol-5-ylamine
TL;DR: 3-Heptylsulfanyl-[1,2,4]thiadiazol-5-ylamine (CAS 215593-27-4) is a chemical compound with molecular formula C9H17N3S2 and molecular weight 231.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-heptylsulfanyl-1,2,4-thiadiazol-5-amine
Also Known As: 3-Heptylsulfanyl-[1,2,4]thiadiazol-5-ylamine, BAS 00280964, 3-(Heptylthio)-1,2,4-thiadiazol-5-amine, 3-heptylsulfanyl-1,2,4-thiadiazol-5-amine, 3-(HEPTYLSULFANYL)-1,2,4-THIADIAZOL-5-AMINE
| Molecular Formula | C9H17N3S2 |
|---|---|
| Molecular Weight | 231.09 g/mol |
| LogP | 3.1828 |
| Topological Polar Surface Area | 51.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 231.0864 |
| Heavy Atoms | 14 |
| Complexity | 249.96004 |
Chemical Identifiers
| CAS Number | 215593-27-4 |
|---|---|
| SMILES | CCCCCCCSC1=NSC(=N1)N |
Product Overview
3-Heptylsulfanyl-[1,2,4]thiadiazol-5-ylamine (CAS 215593-27-4), with molecular formula C9H17N3S2 and molecular weight 231.09 g/mol. IUPAC: 3-heptylsulfanyl-1,2,4-thiadiazol-5-amine.
Chemical Property Profile of 3-Heptylsulfanyl-[1,2,4]thiadiazol-5-ylamine
Property Insights of 3-Heptylsulfanyl-[1,2,4]thiadiazol-5-ylamine
The XLogP value of 3.1828 indicates that 3-Heptylsulfanyl-[1,2,4]thiadiazol-5-ylamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.8 Ų, 3-Heptylsulfanyl-[1,2,4]thiadiazol-5-ylamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Heptylsulfanyl-[1,2,4]thiadiazol-5-ylamine has 1 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-Heptylsulfanyl-[1,2,4]thiadiazol-5-ylamine?
The CAS number of 3-Heptylsulfanyl-[1,2,4]thiadiazol-5-ylamine is 215593-27-4.
What is the molecular formula of 3-Heptylsulfanyl-[1,2,4]thiadiazol-5-ylamine?
The molecular formula of 3-Heptylsulfanyl-[1,2,4]thiadiazol-5-ylamine is C9H17N3S2.
What is the molecular weight of 3-Heptylsulfanyl-[1,2,4]thiadiazol-5-ylamine?
The molecular weight of 3-Heptylsulfanyl-[1,2,4]thiadiazol-5-ylamine is 231.09 g/mol.
Where can I buy 3-Heptylsulfanyl-[1,2,4]thiadiazol-5-ylamine?
You can request a quote for 3-Heptylsulfanyl-[1,2,4]thiadiazol-5-ylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Heptylsulfanyl-[1,2,4]thiadiazol-5-ylamine?
Yes, KEHONG BIO provides custom synthesis services for 3-Heptylsulfanyl-[1,2,4]thiadiazol-5-ylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.