Bionet1_000501
TL;DR: Bionet1_000501 (CAS 338396-00-2) is a chemical compound with molecular formula C19H13F3N2O4 and molecular weight 390.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 6-oxo-4-phenoxy-1-[3-(trifluoromethyl)phenyl]pyridazine-3-carboxylate
Also Known As: Bionet1_000501, methyl 6-oxo-4-phenoxy-1-[3-(trifluoromethyl)phenyl]-1,6-dihydro-3-pyridazinecarboxylate, 2F-099, methyl 6-oxo-4-phenoxy-1-[3-(trifluoromethyl)phenyl]pyridazine-3-carboxylate, methyl 6-oxo-4-phenoxy-1-[3-(trifluoromethyl)phenyl]-1,6-dihydropyridazine-3-carboxylate
| Molecular Formula | C19H13F3N2O4 |
|---|---|
| Molecular Weight | 390.08 g/mol |
| LogP | 3.8302 |
| Topological Polar Surface Area | 70.42 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 390.08273 |
| Heavy Atoms | 28 |
| Complexity | 1062.7642 |
Chemical Identifiers
| CAS Number | 338396-00-2 |
|---|---|
| SMILES | COC(=O)C1=NN(C(=O)C=C1OC2=CC=CC=C2)C3=CC=CC(=C3)C(F)(F)F |
Product Overview
Bionet1_000501 (CAS 338396-00-2), with molecular formula C19H13F3N2O4 and molecular weight 390.08 g/mol. IUPAC: methyl 6-oxo-4-phenoxy-1-[3-(trifluoromethyl)phenyl]pyridazine-3-carboxylate.
Chemical Property Profile of Bionet1_000501
Property Insights of Bionet1_000501
The XLogP value of 3.8302 indicates that Bionet1_000501 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.42 Ų falls within the moderate polarity range, balancing permeability and solubility for Bionet1_000501. Following Lipinski's Rule of Five, Bionet1_000501 has 0 hydrogen bond donor(s) and 5 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_000501?
The CAS number of Bionet1_000501 is 338396-00-2.
What is the molecular formula of Bionet1_000501?
The molecular formula of Bionet1_000501 is C19H13F3N2O4.
What is the molecular weight of Bionet1_000501?
The molecular weight of Bionet1_000501 is 390.08 g/mol.
Where can I buy Bionet1_000501?
You can request a quote for Bionet1_000501 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_000501?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_000501 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.