Bionet1_003269
TL;DR: Bionet1_003269 (CAS 339019-55-5) is a chemical compound with molecular formula C15H13F3N2O2S2 and molecular weight 374.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-methylsulfanyl-4-[3-(trifluoromethyl)phenyl]sulfanylpyrimidine-5-carboxylate
Also Known As: Bionet1_003269, ethyl 2-(methylsulfanyl)-4-{[3-(trifluoromethyl)phenyl]sulfanyl}-5-pyrimidinecarboxylate, 7N-524S, ethyl 2-(methylsulfanyl)-4-{[3-(trifluoromethyl)phenyl]sulfanyl}pyrimidine-5-carboxylate, ethyl 2-methylsulfanyl-4-[3-(trifluoromethyl)phenyl]sulfanylpyrimidine-5-carboxylate
| Molecular Formula | C15H13F3N2O2S2 |
|---|---|
| Molecular Weight | 374.04 g/mol |
| LogP | 4.5452 |
| Topological Polar Surface Area | 52.08 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 374.03705 |
| Heavy Atoms | 24 |
| Complexity | 738.89935 |
Chemical Identifiers
| CAS Number | 339019-55-5 |
|---|---|
| SMILES | CCOC(=O)C1=CN=C(N=C1SC2=CC=CC(=C2)C(F)(F)F)SC |
Product Overview
Bionet1_003269 (CAS 339019-55-5), with molecular formula C15H13F3N2O2S2 and molecular weight 374.04 g/mol. IUPAC: ethyl 2-methylsulfanyl-4-[3-(trifluoromethyl)phenyl]sulfanylpyrimidine-5-carboxylate.
Chemical Property Profile of Bionet1_003269
Property Insights of Bionet1_003269
The XLogP value of 4.5452 indicates that Bionet1_003269 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.08 Ų, Bionet1_003269 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bionet1_003269 has 0 hydrogen bond donor(s) and 6 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_003269?
The CAS number of Bionet1_003269 is 339019-55-5.
What is the molecular formula of Bionet1_003269?
The molecular formula of Bionet1_003269 is C15H13F3N2O2S2.
What is the molecular weight of Bionet1_003269?
The molecular weight of Bionet1_003269 is 374.04 g/mol.
Where can I buy Bionet1_003269?
You can request a quote for Bionet1_003269 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_003269?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_003269 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.