![Diethyl ({[3-chloro-4-(2-furyl)phenyl]amino}methylene)malonate structure](/static/products/207/207399-41-5.png)
Diethyl ({[3-chloro-4-(2-furyl)phenyl]amino}methylene)malonate
TL;DR: Diethyl ({[3-chloro-4-(2-furyl)phenyl]amino}methylene)malonate (CAS 207399-41-5) is a chemical compound with molecular formula C18H18ClNO5 and molecular weight 363.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 2-[[3-chloro-4-(furan-2-yl)anilino]methylidene]propanedioate
Also Known As: diethyl ({[3-chloro-4-(2-furyl)phenyl]amino}methylene)malonate, diethyl ({[3-chloro-4-(furan-2-yl)phenyl]amino}methylidene)propanedioate, diethyl 2-(((3-chloro-4-(furan-2-yl)phenyl)amino)methylene)malonate, diethyl 2-[[3-chloro-4-(furan-2-yl)anilino]methylidene]propanedioate, 1,3-DIETHYL 2-({[3-CHLORO-4-(FURAN-2-YL)PHENYL]AMINO}METHYLIDENE)PROPANEDIOATE
| Molecular Formula | C18H18ClNO5 |
|---|---|
| Molecular Weight | 363.09 g/mol |
| LogP | 4.022 |
| Topological Polar Surface Area | 77.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 363.08734 |
| Heavy Atoms | 25 |
| Complexity | 747.77856 |
Chemical Identifiers
| CAS Number | 207399-41-5 |
|---|---|
| SMILES | CCOC(=O)C(=CNC1=CC(=C(C=C1)C2=CC=CO2)Cl)C(=O)OCC |
Product Overview
Diethyl ({[3-chloro-4-(2-furyl)phenyl]amino}methylene)malonate (CAS 207399-41-5), with molecular formula C18H18ClNO5 and molecular weight 363.09 g/mol. IUPAC: diethyl 2-[[3-chloro-4-(furan-2-yl)anilino]methylidene]propanedioate.
Chemical Property Profile of Diethyl ({[3-chloro-4-(2-furyl)phenyl]amino}methylene)malonate
Property Insights of Diethyl ({[3-chloro-4-(2-furyl)phenyl]amino}methylene)malonate
The XLogP value of 4.022 indicates that Diethyl ({[3-chloro-4-(2-furyl)phenyl]amino}methylene)malonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.77 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl ({[3-chloro-4-(2-furyl)phenyl]amino}methylene)malonate. Following Lipinski's Rule of Five, Diethyl ({[3-chloro-4-(2-furyl)phenyl]amino}methylene)malonate has 1 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 ({[3-chloro-4-(2-furyl)phenyl]amino}methylene)malonate?
The CAS number of Diethyl ({[3-chloro-4-(2-furyl)phenyl]amino}methylene)malonate is 207399-41-5.
What is the molecular formula of Diethyl ({[3-chloro-4-(2-furyl)phenyl]amino}methylene)malonate?
The molecular formula of Diethyl ({[3-chloro-4-(2-furyl)phenyl]amino}methylene)malonate is C18H18ClNO5.
What is the molecular weight of Diethyl ({[3-chloro-4-(2-furyl)phenyl]amino}methylene)malonate?
The molecular weight of Diethyl ({[3-chloro-4-(2-furyl)phenyl]amino}methylene)malonate is 363.09 g/mol.
Where can I buy Diethyl ({[3-chloro-4-(2-furyl)phenyl]amino}methylene)malonate?
You can request a quote for Diethyl ({[3-chloro-4-(2-furyl)phenyl]amino}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 ({[3-chloro-4-(2-furyl)phenyl]amino}methylene)malonate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl ({[3-chloro-4-(2-furyl)phenyl]amino}methylene)malonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.