Diethyl 2-((5-(2,3-dichlorophenyl)-2-furyl)methylene)malonate
TL;DR: Diethyl 2-((5-(2,3-dichlorophenyl)-2-furyl)methylene)malonate (CAS 304896-39-7) is a chemical compound with molecular formula C18H16Cl2O5 and molecular weight 382.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 2-[[5-(2,3-dichlorophenyl)furan-2-yl]methylidene]propanedioate
Also Known As: Diethyl 2-((5-(2,3-dichlorophenyl)furan-2-yl)methylene)malonate, BIM-0035342.P001, DIETHYL 2-((5-(2,3-DICHLOROPHENYL)-2-FURYL)METHYLENE)MALONATE, diethyl 2-[[5-(2,3-dichlorophenyl)furan-2-yl]methylidene]propanedioate, diethyl 2-[[5-(2,3-dichlorophenyl)-2-furyl]methylene]propanedioate
| Molecular Formula | C18H16Cl2O5 |
|---|---|
| Molecular Weight | 382.04 g/mol |
| LogP | 4.763 |
| Topological Polar Surface Area | 65.74 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 382.03748 |
| Heavy Atoms | 25 |
| Complexity | 787.5478 |
Chemical Identifiers
| CAS Number | 304896-39-7 |
|---|---|
| SMILES | CCOC(=O)C(=CC1=CC=C(O1)C2=C(C(=CC=C2)Cl)Cl)C(=O)OCC |
Product Overview
Diethyl 2-((5-(2,3-dichlorophenyl)-2-furyl)methylene)malonate (CAS 304896-39-7), with molecular formula C18H16Cl2O5 and molecular weight 382.04 g/mol. IUPAC: diethyl 2-[[5-(2,3-dichlorophenyl)furan-2-yl]methylidene]propanedioate.
Chemical Property Profile of Diethyl 2-((5-(2,3-dichlorophenyl)-2-furyl)methylene)malonate
Property Insights of Diethyl 2-((5-(2,3-dichlorophenyl)-2-furyl)methylene)malonate
The XLogP value of 4.763 indicates that Diethyl 2-((5-(2,3-dichlorophenyl)-2-furyl)methylene)malonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.74 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl 2-((5-(2,3-dichlorophenyl)-2-furyl)methylene)malonate. Following Lipinski's Rule of Five, Diethyl 2-((5-(2,3-dichlorophenyl)-2-furyl)methylene)malonate 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 Diethyl 2-((5-(2,3-dichlorophenyl)-2-furyl)methylene)malonate?
The CAS number of Diethyl 2-((5-(2,3-dichlorophenyl)-2-furyl)methylene)malonate is 304896-39-7.
What is the molecular formula of Diethyl 2-((5-(2,3-dichlorophenyl)-2-furyl)methylene)malonate?
The molecular formula of Diethyl 2-((5-(2,3-dichlorophenyl)-2-furyl)methylene)malonate is C18H16Cl2O5.
What is the molecular weight of Diethyl 2-((5-(2,3-dichlorophenyl)-2-furyl)methylene)malonate?
The molecular weight of Diethyl 2-((5-(2,3-dichlorophenyl)-2-furyl)methylene)malonate is 382.04 g/mol.
Where can I buy Diethyl 2-((5-(2,3-dichlorophenyl)-2-furyl)methylene)malonate?
You can request a quote for Diethyl 2-((5-(2,3-dichlorophenyl)-2-furyl)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-((5-(2,3-dichlorophenyl)-2-furyl)methylene)malonate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl 2-((5-(2,3-dichlorophenyl)-2-furyl)methylene)malonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.