5G-463S
TL;DR: 5G-463S (CAS 400083-71-8) is a chemical compound with molecular formula C14H11F3N4S2 and molecular weight 356.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-methyl-5-methylsulfanyl-1,2,4-triazol-3-yl)-2-[3-(trifluoromethyl)phenyl]-1,3-thiazole
Also Known As: 5G-463S, 4-methyl-3-(methylsulfanyl)-5-{2-[3-(trifluoromethyl)phenyl]-1,3-thiazol-4-yl}-4H-1,2,4-triazole, 4-(4-methyl-5-methylsulfanyl-1,2,4-triazol-3-yl)-2-[3-(trifluoromethyl)phenyl]-1,3-thiazole
| Molecular Formula | C14H11F3N4S2 |
|---|---|
| Molecular Weight | 356.04 g/mol |
| LogP | 4.3463 |
| Topological Polar Surface Area | 43.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 356.03772 |
| Heavy Atoms | 23 |
| Complexity | 838.66266 |
Chemical Identifiers
| CAS Number | 400083-71-8 |
|---|---|
| SMILES | CN1C(=NN=C1SC)C2=CSC(=N2)C3=CC(=CC=C3)C(F)(F)F |
Product Overview
5G-463S (CAS 400083-71-8), with molecular formula C14H11F3N4S2 and molecular weight 356.04 g/mol. IUPAC: 4-(4-methyl-5-methylsulfanyl-1,2,4-triazol-3-yl)-2-[3-(trifluoromethyl)phenyl]-1,3-thiazole.
Chemical Property Profile of 5G-463S
Property Insights of 5G-463S
The XLogP value of 4.3463 indicates that 5G-463S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.6 Ų, 5G-463S exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5G-463S has 0 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 5G-463S?
The CAS number of 5G-463S is 400083-71-8.
What is the molecular formula of 5G-463S?
The molecular formula of 5G-463S is C14H11F3N4S2.
What is the molecular weight of 5G-463S?
The molecular weight of 5G-463S is 356.04 g/mol.
Where can I buy 5G-463S?
You can request a quote for 5G-463S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5G-463S?
Yes, KEHONG BIO provides custom synthesis services for 5G-463S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.