Bionet1_004213
TL;DR: Bionet1_004213 (CAS 477709-05-0) is a chemical compound with molecular formula C16H16F4N4O and molecular weight 356.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(2-fluorophenyl)piperazin-1-yl]-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]methanone
Also Known As: Bionet1_004213, DivK1c_002709, CDS1_001669, 11M-324S, [4-(2-fluorophenyl)piperazino][1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]methanone
| Molecular Formula | C16H16F4N4O |
|---|---|
| Molecular Weight | 356.13 g/mol |
| LogP | 2.5404 |
| Topological Polar Surface Area | 41.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 356.12604 |
| Heavy Atoms | 25 |
| Complexity | 778.6822 |
Chemical Identifiers
| CAS Number | 477709-05-0 |
|---|---|
| SMILES | CN1C=C(C(=N1)C(F)(F)F)C(=O)N2CCN(CC2)C3=CC=CC=C3F |
Product Overview
Bionet1_004213 (CAS 477709-05-0), with molecular formula C16H16F4N4O and molecular weight 356.13 g/mol. IUPAC: [4-(2-fluorophenyl)piperazin-1-yl]-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]methanone.
Chemical Property Profile of Bionet1_004213
Property Insights of Bionet1_004213
The XLogP value of 2.5404 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bionet1_004213. With a topological polar surface area (TPSA) of 41.37 Ų, Bionet1_004213 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bionet1_004213 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_004213?
The CAS number of Bionet1_004213 is 477709-05-0.
What is the molecular formula of Bionet1_004213?
The molecular formula of Bionet1_004213 is C16H16F4N4O.
What is the molecular weight of Bionet1_004213?
The molecular weight of Bionet1_004213 is 356.13 g/mol.
Where can I buy Bionet1_004213?
You can request a quote for Bionet1_004213 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_004213?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_004213 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.