![Diethyl 2-[(2-{4-[(2-furylcarbonyl)oxy]phenyl}-4-pyrimidinyl)methylene]malonate structure](/static/products/4778/477870-98-7.webp)
Diethyl 2-[(2-{4-[(2-furylcarbonyl)oxy]phenyl}-4-pyrimidinyl)methylene]malonate
TL;DR: Diethyl 2-[(2-{4-[(2-furylcarbonyl)oxy]phenyl}-4-pyrimidinyl)methylene]malonate (CAS 477870-98-7) is a chemical compound with molecular formula C23H20N2O7 and molecular weight 436.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 2-[[2-[4-(furan-2-carbonyloxy)phenyl]pyrimidin-4-yl]methylidene]propanedioate
Also Known As: 1R-0168, diethyl 2-[(2-{4-[(2-furylcarbonyl)oxy]phenyl}-4-pyrimidinyl)methylene]malonate, Diethyl 2-[[2-[4-(furan-2-carbonyloxy)phenyl]pyrimidin-4-yl]methylidene]propanedioate, 1,3-diethyl 2-({2-[4-(furan-2-carbonyloxy)phenyl]pyrimidin-4-yl}methylidene)propanedioate, 1,3-diethyl2-({2-[4-(furan-2-carbonyloxy)phenyl]pyrimidin-4-yl}methylidene)propanedioate
| Molecular Formula | C23H20N2O7 |
|---|---|
| Molecular Weight | 436.13 g/mol |
| LogP | 3.4654 |
| Topological Polar Surface Area | 117.82 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 8 |
| Exact Mass | 436.12704 |
| Heavy Atoms | 32 |
| Complexity | 1099.5114 |
Chemical Identifiers
| CAS Number | 477870-98-7 |
|---|---|
| SMILES | CCOC(=O)C(=CC1=NC(=NC=C1)C2=CC=C(C=C2)OC(=O)C3=CC=CO3)C(=O)OCC |
Product Overview
Diethyl 2-[(2-{4-[(2-furylcarbonyl)oxy]phenyl}-4-pyrimidinyl)methylene]malonate (CAS 477870-98-7), with molecular formula C23H20N2O7 and molecular weight 436.13 g/mol. IUPAC: diethyl 2-[[2-[4-(furan-2-carbonyloxy)phenyl]pyrimidin-4-yl]methylidene]propanedioate.
Chemical Property Profile of Diethyl 2-[(2-{4-[(2-furylcarbonyl)oxy]phenyl}-4-pyrimidinyl)methylene]malonate
Property Insights of Diethyl 2-[(2-{4-[(2-furylcarbonyl)oxy]phenyl}-4-pyrimidinyl)methylene]malonate
The XLogP value of 3.4654 indicates that Diethyl 2-[(2-{4-[(2-furylcarbonyl)oxy]phenyl}-4-pyrimidinyl)methylene]malonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 117.82 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl 2-[(2-{4-[(2-furylcarbonyl)oxy]phenyl}-4-pyrimidinyl)methylene]malonate. Following Lipinski's Rule of Five, Diethyl 2-[(2-{4-[(2-furylcarbonyl)oxy]phenyl}-4-pyrimidinyl)methylene]malonate has 0 hydrogen bond donor(s) and 9 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-[(2-{4-[(2-furylcarbonyl)oxy]phenyl}-4-pyrimidinyl)methylene]malonate?
The CAS number of Diethyl 2-[(2-{4-[(2-furylcarbonyl)oxy]phenyl}-4-pyrimidinyl)methylene]malonate is 477870-98-7.
What is the molecular formula of Diethyl 2-[(2-{4-[(2-furylcarbonyl)oxy]phenyl}-4-pyrimidinyl)methylene]malonate?
The molecular formula of Diethyl 2-[(2-{4-[(2-furylcarbonyl)oxy]phenyl}-4-pyrimidinyl)methylene]malonate is C23H20N2O7.
What is the molecular weight of Diethyl 2-[(2-{4-[(2-furylcarbonyl)oxy]phenyl}-4-pyrimidinyl)methylene]malonate?
The molecular weight of Diethyl 2-[(2-{4-[(2-furylcarbonyl)oxy]phenyl}-4-pyrimidinyl)methylene]malonate is 436.13 g/mol.
Where can I buy Diethyl 2-[(2-{4-[(2-furylcarbonyl)oxy]phenyl}-4-pyrimidinyl)methylene]malonate?
You can request a quote for Diethyl 2-[(2-{4-[(2-furylcarbonyl)oxy]phenyl}-4-pyrimidinyl)methylene]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-[(2-{4-[(2-furylcarbonyl)oxy]phenyl}-4-pyrimidinyl)methylene]malonate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl 2-[(2-{4-[(2-furylcarbonyl)oxy]phenyl}-4-pyrimidinyl)methylene]malonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.