Bionet1_004914
TL;DR: Bionet1_004914 (CAS 692287-62-0) is a chemical compound with molecular formula C15H12ClF3N2O2S and molecular weight 376.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-3-ethyl-6-(trifluoromethyl)pyrimidin-4-one
Also Known As: Bionet1_004914, MixCom3_000161, 2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-3-ethyl-6-(trifluoromethyl)-4(3H)-pyrimidinone, 2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-3-ethyl-6-(trifluoromethyl)-3,4-dihydropyrimidin-4-one, 2-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-3-ethyl-6-(trifluoromethyl)pyrimidin-4-one
| Molecular Formula | C15H12ClF3N2O2S |
|---|---|
| Molecular Weight | 376.03 g/mol |
| LogP | 3.9104 |
| Topological Polar Surface Area | 51.96 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 376.026 |
| Heavy Atoms | 24 |
| Complexity | 803.847 |
Chemical Identifiers
| CAS Number | 692287-62-0 |
|---|---|
| SMILES | CCN1C(=O)C=C(N=C1SCC(=O)C2=CC=C(C=C2)Cl)C(F)(F)F |
Product Overview
Bionet1_004914 (CAS 692287-62-0), with molecular formula C15H12ClF3N2O2S and molecular weight 376.03 g/mol. IUPAC: 2-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-3-ethyl-6-(trifluoromethyl)pyrimidin-4-one.
Chemical Property Profile of Bionet1_004914
Property Insights of Bionet1_004914
The XLogP value of 3.9104 indicates that Bionet1_004914 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.96 Ų, Bionet1_004914 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bionet1_004914 has 0 hydrogen bond donor(s) and 4 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_004914?
The CAS number of Bionet1_004914 is 692287-62-0.
What is the molecular formula of Bionet1_004914?
The molecular formula of Bionet1_004914 is C15H12ClF3N2O2S.
What is the molecular weight of Bionet1_004914?
The molecular weight of Bionet1_004914 is 376.03 g/mol.
Where can I buy Bionet1_004914?
You can request a quote for Bionet1_004914 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_004914?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_004914 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.