Bionet1_004830
TL;DR: Bionet1_004830 (CAS 439112-40-0) is a chemical compound with molecular formula C18H17FN4S2 and molecular weight 372.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-ethyl-5-(3-fluoropropylsulfanyl)-1,2,4-triazol-3-yl]thieno[2,3-b]quinoline
Also Known As: Bionet1_004830, 8R-1135, 2-{4-ethyl-5-[(3-fluoropropyl)sulfanyl]-4H-1,2,4-triazol-3-yl}thieno[2,3-b]quinoline, 2-[4-ethyl-5-(3-fluoropropylsulfanyl)-1,2,4-triazol-3-yl]thieno[2,3-b]quinoline, 4-ethyl-3-[(3-fluoropropyl)sulfanyl]-5-{thieno[2,3-b]quinolin-2-yl}-4H-1,2,4-triazole
| Molecular Formula | C18H17FN4S2 |
|---|---|
| Molecular Weight | 372.09 g/mol |
| LogP | 5.1796 |
| Topological Polar Surface Area | 43.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 372.08786 |
| Heavy Atoms | 25 |
| Complexity | 971.9469 |
Chemical Identifiers
| CAS Number | 439112-40-0 |
|---|---|
| SMILES | CCN1C(=NN=C1SCCCF)C2=CC3=CC4=CC=CC=C4N=C3S2 |
Product Overview
Bionet1_004830 (CAS 439112-40-0), with molecular formula C18H17FN4S2 and molecular weight 372.09 g/mol. IUPAC: 2-[4-ethyl-5-(3-fluoropropylsulfanyl)-1,2,4-triazol-3-yl]thieno[2,3-b]quinoline.
Chemical Property Profile of Bionet1_004830
Property Insights of Bionet1_004830
The XLogP value of 5.1796 indicates that Bionet1_004830 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_004830 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bionet1_004830 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Bionet1_004830?
The CAS number of Bionet1_004830 is 439112-40-0.
What is the molecular formula of Bionet1_004830?
The molecular formula of Bionet1_004830 is C18H17FN4S2.
What is the molecular weight of Bionet1_004830?
The molecular weight of Bionet1_004830 is 372.09 g/mol.
Where can I buy Bionet1_004830?
You can request a quote for Bionet1_004830 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_004830?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_004830 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.