Bionet1_001700
TL;DR: Bionet1_001700 (CAS 339010-60-5) is a chemical compound with molecular formula C17H14ClF3N4S and molecular weight 398.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-2-[1-(5-methylsulfanyl-4-phenyl-1,2,4-triazol-3-yl)ethyl]-5-(trifluoromethyl)pyridine
Also Known As: Bionet1_001700, 7G-036, 3-Chloro-2-(1-(5-(methylsulfanyl)-4-phenyl-4H-1,2,4-triazol-3-yl)ethyl)-5-(trifluoromethyl)pyridine, 3-chloro-2-{1-[5-(methylsulfanyl)-4-phenyl-4H-1,2,4-triazol-3-yl]ethyl}-5-(trifluoromethyl)pyridine, 3-chloro-2-[1-(5-methylsulfanyl-4-phenyl-1,2,4-triazol-3-yl)ethyl]-5-(trifluoromethyl)pyridine
| Molecular Formula | C17H14ClF3N4S |
|---|---|
| Molecular Weight | 398.06 g/mol |
| LogP | 5.2082 |
| Topological Polar Surface Area | 43.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 398.05798 |
| Heavy Atoms | 26 |
| Complexity | 912.11664 |
Chemical Identifiers
| CAS Number | 339010-60-5 |
|---|---|
| SMILES | CC(C1=C(C=C(C=N1)C(F)(F)F)Cl)C2=NN=C(N2C3=CC=CC=C3)SC |
Product Overview
Bionet1_001700 (CAS 339010-60-5), with molecular formula C17H14ClF3N4S and molecular weight 398.06 g/mol. IUPAC: 3-chloro-2-[1-(5-methylsulfanyl-4-phenyl-1,2,4-triazol-3-yl)ethyl]-5-(trifluoromethyl)pyridine.
Chemical Property Profile of Bionet1_001700
Property Insights of Bionet1_001700
The XLogP value of 5.2082 indicates that Bionet1_001700 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.6 Ų, Bionet1_001700 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bionet1_001700 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Bionet1_001700?
The CAS number of Bionet1_001700 is 339010-60-5.
What is the molecular formula of Bionet1_001700?
The molecular formula of Bionet1_001700 is C17H14ClF3N4S.
What is the molecular weight of Bionet1_001700?
The molecular weight of Bionet1_001700 is 398.06 g/mol.
Where can I buy Bionet1_001700?
You can request a quote for Bionet1_001700 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_001700?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_001700 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.