Bionet1_000361
TL;DR: Bionet1_000361 (CAS 338778-67-9) is a chemical compound with molecular formula C15H13ClFN3S2 and molecular weight 353.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(2-chloro-6-fluorophenyl)methylsulfanyl]-5-[2-(dimethylamino)ethenyl]-1,2-thiazole-4-carbonitrile
Also Known As: Bionet1_000361, DivK1c_002377, CDS1_001337, 3-[(2-chloro-6-fluorobenzyl)sulfanyl]-5-[2-(dimethylamino)vinyl]-4-isothiazolecarbonitrile, 3-[(2-chloro-6-fluorophenyl)methylsulfanyl]-5-[2-(dimethylamino)ethenyl]-1,2-thiazole-4-carbonitrile
| Molecular Formula | C15H13ClFN3S2 |
|---|---|
| Molecular Weight | 353.02 g/mol |
| LogP | 4.63188 |
| Topological Polar Surface Area | 39.92 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 353.02234 |
| Heavy Atoms | 22 |
| Complexity | 714.62415 |
Chemical Identifiers
| CAS Number | 338778-67-9 |
|---|---|
| SMILES | CN(C)C=CC1=C(C(=NS1)SCC2=C(C=CC=C2Cl)F)C#N |
Product Overview
Bionet1_000361 (CAS 338778-67-9), with molecular formula C15H13ClFN3S2 and molecular weight 353.02 g/mol. IUPAC: 3-[(2-chloro-6-fluorophenyl)methylsulfanyl]-5-[2-(dimethylamino)ethenyl]-1,2-thiazole-4-carbonitrile.
Chemical Property Profile of Bionet1_000361
Property Insights of Bionet1_000361
The XLogP value of 4.63188 indicates that Bionet1_000361 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.92 Ų, Bionet1_000361 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bionet1_000361 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 Bionet1_000361?
The CAS number of Bionet1_000361 is 338778-67-9.
What is the molecular formula of Bionet1_000361?
The molecular formula of Bionet1_000361 is C15H13ClFN3S2.
What is the molecular weight of Bionet1_000361?
The molecular weight of Bionet1_000361 is 353.02 g/mol.
Where can I buy Bionet1_000361?
You can request a quote for Bionet1_000361 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_000361?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_000361 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.