Bionet1_002058
TL;DR: Bionet1_002058 (CAS 338960-24-0) is a chemical compound with molecular formula C17H15F3N2O4 and molecular weight 368.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-[1-(dimethylamino)-4,4,4-trifluoro-3-oxobut-1-en-2-yl]-3-phenyl-1,2-oxazole-4-carboxylate
Also Known As: Bionet1_002058, methyl 5-[2-(dimethylamino)-1-(2,2,2-trifluoroacetyl)vinyl]-3-phenyl-4-isoxazolecarboxylate, methyl 5-[1-(dimethylamino)-4,4,4-trifluoro-3-oxobut-1-en-2-yl]-3-phenyl-1,2-oxazole-4-carboxylate
| Molecular Formula | C17H15F3N2O4 |
|---|---|
| Molecular Weight | 368.10 g/mol |
| LogP | 3.1621 |
| Topological Polar Surface Area | 72.64 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 368.0984 |
| Heavy Atoms | 26 |
| Complexity | 839.43805 |
Chemical Identifiers
| CAS Number | 338960-24-0 |
|---|---|
| SMILES | CN(C)C=C(C1=C(C(=NO1)C2=CC=CC=C2)C(=O)OC)C(=O)C(F)(F)F |
Product Overview
Bionet1_002058 (CAS 338960-24-0), with molecular formula C17H15F3N2O4 and molecular weight 368.10 g/mol. IUPAC: methyl 5-[1-(dimethylamino)-4,4,4-trifluoro-3-oxobut-1-en-2-yl]-3-phenyl-1,2-oxazole-4-carboxylate.
Chemical Property Profile of Bionet1_002058
Property Insights of Bionet1_002058
The XLogP value of 3.1621 indicates that Bionet1_002058 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.64 Ų falls within the moderate polarity range, balancing permeability and solubility for Bionet1_002058. Following Lipinski's Rule of Five, Bionet1_002058 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_002058?
The CAS number of Bionet1_002058 is 338960-24-0.
What is the molecular formula of Bionet1_002058?
The molecular formula of Bionet1_002058 is C17H15F3N2O4.
What is the molecular weight of Bionet1_002058?
The molecular weight of Bionet1_002058 is 368.10 g/mol.
Where can I buy Bionet1_002058?
You can request a quote for Bionet1_002058 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_002058?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_002058 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.