![Diethyl 2-[5,7-bis(trifluoromethyl)[1,8]naphthyridin-2-yl]malonate structure](/static/products/3383/338396-74-0.webp)
Diethyl 2-[5,7-bis(trifluoromethyl)[1,8]naphthyridin-2-yl]malonate
TL;DR: Diethyl 2-[5,7-bis(trifluoromethyl)[1,8]naphthyridin-2-yl]malonate (CAS 338396-74-0) is a chemical compound with molecular formula C17H14F6N2O4 and molecular weight 424.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 2-[5,7-bis(trifluoromethyl)-1,8-naphthyridin-2-yl]propanedioate
Also Known As: diethyl 2-[5,7-bis(trifluoromethyl)[1,8]naphthyridin-2-yl]malonate, 2G-010, Diethyl 2-[5,7-bis(trifluoromethyl)-1,8-naphthyridin-2-yl]propanedioate, 1,3-diethyl 2-[5,7-bis(trifluoromethyl)-1,8-naphthyridin-2-yl]propanedioate, Diethyl [5,7-bis(trifluoromethyl)-1,8-naphthyridin-2-yl]propanedioate
| Molecular Formula | C17H14F6N2O4 |
|---|---|
| Molecular Weight | 424.09 g/mol |
| LogP | 3.8772 |
| Topological Polar Surface Area | 78.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 424.0858 |
| Heavy Atoms | 29 |
| Complexity | 908.5047 |
Chemical Identifiers
| CAS Number | 338396-74-0 |
|---|---|
| SMILES | CCOC(=O)C(C1=NC2=C(C=C1)C(=CC(=N2)C(F)(F)F)C(F)(F)F)C(=O)OCC |
Product Overview
Diethyl 2-[5,7-bis(trifluoromethyl)[1,8]naphthyridin-2-yl]malonate (CAS 338396-74-0), with molecular formula C17H14F6N2O4 and molecular weight 424.09 g/mol. IUPAC: diethyl 2-[5,7-bis(trifluoromethyl)-1,8-naphthyridin-2-yl]propanedioate.
Chemical Property Profile of Diethyl 2-[5,7-bis(trifluoromethyl)[1,8]naphthyridin-2-yl]malonate
Property Insights of Diethyl 2-[5,7-bis(trifluoromethyl)[1,8]naphthyridin-2-yl]malonate
The XLogP value of 3.8772 indicates that Diethyl 2-[5,7-bis(trifluoromethyl)[1,8]naphthyridin-2-yl]malonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.38 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl 2-[5,7-bis(trifluoromethyl)[1,8]naphthyridin-2-yl]malonate. Following Lipinski's Rule of Five, Diethyl 2-[5,7-bis(trifluoromethyl)[1,8]naphthyridin-2-yl]malonate 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 Diethyl 2-[5,7-bis(trifluoromethyl)[1,8]naphthyridin-2-yl]malonate?
The CAS number of Diethyl 2-[5,7-bis(trifluoromethyl)[1,8]naphthyridin-2-yl]malonate is 338396-74-0.
What is the molecular formula of Diethyl 2-[5,7-bis(trifluoromethyl)[1,8]naphthyridin-2-yl]malonate?
The molecular formula of Diethyl 2-[5,7-bis(trifluoromethyl)[1,8]naphthyridin-2-yl]malonate is C17H14F6N2O4.
What is the molecular weight of Diethyl 2-[5,7-bis(trifluoromethyl)[1,8]naphthyridin-2-yl]malonate?
The molecular weight of Diethyl 2-[5,7-bis(trifluoromethyl)[1,8]naphthyridin-2-yl]malonate is 424.09 g/mol.
Where can I buy Diethyl 2-[5,7-bis(trifluoromethyl)[1,8]naphthyridin-2-yl]malonate?
You can request a quote for Diethyl 2-[5,7-bis(trifluoromethyl)[1,8]naphthyridin-2-yl]malonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl 2-[5,7-bis(trifluoromethyl)[1,8]naphthyridin-2-yl]malonate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl 2-[5,7-bis(trifluoromethyl)[1,8]naphthyridin-2-yl]malonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.