6-Chloropyrazine-2-carbothioamide
TL;DR: 6-Chloropyrazine-2-carbothioamide (CAS 61689-61-0) is a chemical compound with molecular formula C5H4ClN3S and molecular weight 172.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloropyrazine-2-carbothioamide
Also Known As: 6-chloropyrazine-2-carbothioamide, Pyrazinecarbothioamide, 6-chloro-, 2-Pyrazinecarbothioamide, 6-chloro-, amino(6-chloropyrazin-2-yl)methane-1-thione, C5H4ClN3S
| Molecular Formula | C5H4ClN3S |
|---|---|
| Molecular Weight | 172.98 g/mol |
| LogP | 0.7642 |
| Topological Polar Surface Area | 51.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 172.98145 |
| Heavy Atoms | 10 |
| Complexity | 262.82492 |
Chemical Identifiers
| CAS Number | 61689-61-0 |
|---|---|
| SMILES | C1=C(N=C(C=N1)Cl)C(=S)N |
Product Overview
6-Chloropyrazine-2-carbothioamide (CAS 61689-61-0), with molecular formula C5H4ClN3S and molecular weight 172.98 g/mol. IUPAC: 6-chloropyrazine-2-carbothioamide.
Chemical Property Profile of 6-Chloropyrazine-2-carbothioamide
Property Insights of 6-Chloropyrazine-2-carbothioamide
The XLogP value of 0.7642 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Chloropyrazine-2-carbothioamide. With a topological polar surface area (TPSA) of 51.8 Ų, 6-Chloropyrazine-2-carbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Chloropyrazine-2-carbothioamide has 1 hydrogen bond donor(s) and 3 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 6-Chloropyrazine-2-carbothioamide?
The CAS number of 6-Chloropyrazine-2-carbothioamide is 61689-61-0.
What is the molecular formula of 6-Chloropyrazine-2-carbothioamide?
The molecular formula of 6-Chloropyrazine-2-carbothioamide is C5H4ClN3S.
What is the molecular weight of 6-Chloropyrazine-2-carbothioamide?
The molecular weight of 6-Chloropyrazine-2-carbothioamide is 172.98 g/mol.
Where can I buy 6-Chloropyrazine-2-carbothioamide?
You can request a quote for 6-Chloropyrazine-2-carbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Chloropyrazine-2-carbothioamide?
Yes, KEHONG BIO provides custom synthesis services for 6-Chloropyrazine-2-carbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.