7G-039
TL;DR: 7G-039 (CAS 339010-63-8) is a chemical compound with molecular formula C11H10ClF3N4S and molecular weight 322.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]ethyl]-4-methyl-1H-1,2,4-triazole-5-thione
Also Known As: 7G-039, 5-(1-(3-Chloro-5-(trifluoromethyl)-2-pyridinyl)ethyl)-4-methyl-4H-1,2,4-triazole-3-thiol, 3-[1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]ethyl]-4-methyl-1H-1,2,4-triazole-5-thione, 5-{1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]ethyl}-4-methyl-4H-1,2,4-triazole-3-thiol, 5-{1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]ethyl}-4-methyl-4H-1,2,4-triazole-3-thiol
| Molecular Formula | C11H10ClF3N4S |
|---|---|
| Molecular Weight | 322.03 g/mol |
| LogP | 3.69669 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 322.02667 |
| Heavy Atoms | 20 |
| Complexity | 691.70715 |
Chemical Identifiers
| CAS Number | 339010-63-8 |
|---|---|
| SMILES | CC(C1=C(C=C(C=N1)C(F)(F)F)Cl)C2=NNC(=S)N2C |
Product Overview
7G-039 (CAS 339010-63-8), with molecular formula C11H10ClF3N4S and molecular weight 322.03 g/mol. IUPAC: 3-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]ethyl]-4-methyl-1H-1,2,4-triazole-5-thione.
Chemical Property Profile of 7G-039
Property Insights of 7G-039
The XLogP value of 3.69669 indicates that 7G-039 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, 7G-039 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7G-039 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 7G-039?
The CAS number of 7G-039 is 339010-63-8.
What is the molecular formula of 7G-039?
The molecular formula of 7G-039 is C11H10ClF3N4S.
What is the molecular weight of 7G-039?
The molecular weight of 7G-039 is 322.03 g/mol.
Where can I buy 7G-039?
You can request a quote for 7G-039 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7G-039?
Yes, KEHONG BIO provides custom synthesis services for 7G-039 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.