9F-923
TL;DR: 9F-923 (CAS 338979-15-0) is a chemical compound with molecular formula C19H18ClF3N6S and molecular weight 454.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]methyl]-4-phenyl-1H-1,2,4-triazole-5-thione
Also Known As: 9F-923, 5-({4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazino}methyl)-4-phenyl-4H-1,2,4-triazole-3-thiol, 3-[[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]methyl]-4-phenyl-1H-1,2,4-triazole-5-thione, 5-({4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl}methyl)-4-phenyl-4H-1,2,4-triazole-3-thiol
| Molecular Formula | C19H18ClF3N6S |
|---|---|
| Molecular Weight | 454.10 g/mol |
| LogP | 4.31929 |
| Topological Polar Surface Area | 52.98 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 454.09543 |
| Heavy Atoms | 30 |
| Complexity | 1073.864 |
Chemical Identifiers
| CAS Number | 338979-15-0 |
|---|---|
| SMILES | C1CN(CCN1CC2=NNC(=S)N2C3=CC=CC=C3)C4=C(C=C(C=N4)C(F)(F)F)Cl |
Product Overview
9F-923 (CAS 338979-15-0), with molecular formula C19H18ClF3N6S and molecular weight 454.10 g/mol. IUPAC: 3-[[4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]methyl]-4-phenyl-1H-1,2,4-triazole-5-thione.
Chemical Property Profile of 9F-923
Property Insights of 9F-923
The XLogP value of 4.31929 indicates that 9F-923 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.98 Ų, 9F-923 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9F-923 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 9F-923?
The CAS number of 9F-923 is 338979-15-0.
What is the molecular formula of 9F-923?
The molecular formula of 9F-923 is C19H18ClF3N6S.
What is the molecular weight of 9F-923?
The molecular weight of 9F-923 is 454.10 g/mol.
Where can I buy 9F-923?
You can request a quote for 9F-923 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9F-923?
Yes, KEHONG BIO provides custom synthesis services for 9F-923 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.