2F-097
TL;DR: 2F-097 (CAS 338395-96-3) is a chemical compound with molecular formula C20H15F3N2O5 and molecular weight 420.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 1-(4-methoxyphenyl)-6-oxo-4-[3-(trifluoromethyl)phenoxy]pyridazine-3-carboxylate
Also Known As: 2F-097, Methyl 1-(4-methoxyphenyl)-6-oxo-4-[3-(trifluoromethyl)phenoxy]pyridazine-3-carboxylate, methyl 1-(4-methoxyphenyl)-6-oxo-4-[3-(trifluoromethyl)phenoxy]-1,6-dihydro-3-pyridazinecarboxylate, methyl 1-(4-methoxyphenyl)-6-oxo-4-[3-(trifluoromethyl)phenoxy]-1,6-dihydropyridazine-3-carboxylate, methyl1-(4-methoxyphenyl)-6-oxo-4-[3-(trifluoromethyl)phenoxy]-1,6-dihydropyridazine-3-carboxylate
| Molecular Formula | C20H15F3N2O5 |
|---|---|
| Molecular Weight | 420.09 g/mol |
| LogP | 3.8388 |
| Topological Polar Surface Area | 79.65 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 420.0933 |
| Heavy Atoms | 30 |
| Complexity | 1124.5212 |
Chemical Identifiers
| CAS Number | 338395-96-3 |
|---|---|
| SMILES | COC1=CC=C(C=C1)N2C(=O)C=C(C(=N2)C(=O)OC)OC3=CC=CC(=C3)C(F)(F)F |
Product Overview
2F-097 (CAS 338395-96-3), with molecular formula C20H15F3N2O5 and molecular weight 420.09 g/mol. IUPAC: methyl 1-(4-methoxyphenyl)-6-oxo-4-[3-(trifluoromethyl)phenoxy]pyridazine-3-carboxylate.
Chemical Property Profile of 2F-097
Property Insights of 2F-097
The XLogP value of 3.8388 indicates that 2F-097 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.65 Ų falls within the moderate polarity range, balancing permeability and solubility for 2F-097. Following Lipinski's Rule of Five, 2F-097 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 2F-097?
The CAS number of 2F-097 is 338395-96-3.
What is the molecular formula of 2F-097?
The molecular formula of 2F-097 is C20H15F3N2O5.
What is the molecular weight of 2F-097?
The molecular weight of 2F-097 is 420.09 g/mol.
Where can I buy 2F-097?
You can request a quote for 2F-097 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2F-097?
Yes, KEHONG BIO provides custom synthesis services for 2F-097 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.