Bionet1_001546
TL;DR: Bionet1_001546 (CAS 339101-77-8) is a chemical compound with molecular formula C14H10F6N2OS and molecular weight 368.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-6-(trifluoromethyl)-2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]pyrimidin-4-one
Also Known As: Bionet1_001546, 8J-523S, 3-Methyl-6-(trifluoromethyl)-2-((3-(trifluoromethyl)benzyl)sulfanyl)-4(3H)-pyrimidinone, 3-methyl-6-(trifluoromethyl)-2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]pyrimidin-4-one, 3-methyl-6-(trifluoromethyl)-2-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-3,4-dihydropyrimidin-4-one
| Molecular Formula | C14H10F6N2OS |
|---|---|
| Molecular Weight | 368.04 g/mol |
| LogP | 4.1102 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 368.0418 |
| Heavy Atoms | 24 |
| Complexity | 797.0724 |
Chemical Identifiers
| CAS Number | 339101-77-8 |
|---|---|
| SMILES | CN1C(=O)C=C(N=C1SCC2=CC(=CC=C2)C(F)(F)F)C(F)(F)F |
Product Overview
Bionet1_001546 (CAS 339101-77-8), with molecular formula C14H10F6N2OS and molecular weight 368.04 g/mol. IUPAC: 3-methyl-6-(trifluoromethyl)-2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]pyrimidin-4-one.
Chemical Property Profile of Bionet1_001546
Property Insights of Bionet1_001546
The XLogP value of 4.1102 indicates that Bionet1_001546 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.89 Ų, Bionet1_001546 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bionet1_001546 has 0 hydrogen bond donor(s) and 3 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_001546?
The CAS number of Bionet1_001546 is 339101-77-8.
What is the molecular formula of Bionet1_001546?
The molecular formula of Bionet1_001546 is C14H10F6N2OS.
What is the molecular weight of Bionet1_001546?
The molecular weight of Bionet1_001546 is 368.04 g/mol.
Where can I buy Bionet1_001546?
You can request a quote for Bionet1_001546 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_001546?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_001546 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.