Bionet1_000818
TL;DR: Bionet1_000818 (CAS 338417-71-3) is a chemical compound with molecular formula C18H11ClF2N4S and molecular weight 388.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2-chloro-6-fluorophenyl)methylsulfanyl]-7-(4-fluorophenyl)-[1,2,4]triazolo[1,5-a]pyrimidine
Also Known As: Bionet1_000818, 4D-023, 2-[(2-chloro-6-fluorobenzyl)sulfanyl]-7-(4-fluorophenyl)[1,2,4]triazolo[1,5-a]pyrimidine, 2-[(2-chloro-6-fluorophenyl)methylsulfanyl]-7-(4-fluorophenyl)-[1,2,4]triazolo[1,5-a]pyrimidine, 2-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-7-(4-fluorophenyl)-[1,2,4]triazolo[1,5-a]pyrimidine
| Molecular Formula | C18H11ClF2N4S |
|---|---|
| Molecular Weight | 388.04 g/mol |
| LogP | 5.0152 |
| Topological Polar Surface Area | 43.08 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 388.0361 |
| Heavy Atoms | 26 |
| Complexity | 1062.1963 |
Chemical Identifiers
| CAS Number | 338417-71-3 |
|---|---|
| SMILES | C1=CC(=C(C(=C1)Cl)CSC2=NN3C(=CC=NC3=N2)C4=CC=C(C=C4)F)F |
Product Overview
Bionet1_000818 (CAS 338417-71-3), with molecular formula C18H11ClF2N4S and molecular weight 388.04 g/mol. IUPAC: 2-[(2-chloro-6-fluorophenyl)methylsulfanyl]-7-(4-fluorophenyl)-[1,2,4]triazolo[1,5-a]pyrimidine.
Chemical Property Profile of Bionet1_000818
Property Insights of Bionet1_000818
The XLogP value of 5.0152 indicates that Bionet1_000818 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.08 Ų, Bionet1_000818 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bionet1_000818 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_000818?
The CAS number of Bionet1_000818 is 338417-71-3.
What is the molecular formula of Bionet1_000818?
The molecular formula of Bionet1_000818 is C18H11ClF2N4S.
What is the molecular weight of Bionet1_000818?
The molecular weight of Bionet1_000818 is 388.04 g/mol.
Where can I buy Bionet1_000818?
You can request a quote for Bionet1_000818 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_000818?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_000818 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.