Ethyl 4-(5-(4-methoxy-2-nitrophenyl)furan-2-carboxamido)benzoate
TL;DR: Ethyl 4-(5-(4-methoxy-2-nitrophenyl)furan-2-carboxamido)benzoate (CAS 890645-39-3) is a chemical compound with molecular formula C21H18N2O7 and molecular weight 410.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[[5-(4-methoxy-2-nitrophenyl)furan-2-carbonyl]amino]benzoate
Also Known As: VU0607153-1, ETHYL 4-[5-(4-METHOXY-2-NITROPHENYL)FURAN-2-AMIDO]BENZOATE, ethyl 4-(5-(4-methoxy-2-nitrophenyl)furan-2-carboxamido)benzoate, F3244-0343, ethyl 4-[[5-(4-methoxy-2-nitrophenyl)furan-2-carbonyl]amino]benzoate
| Molecular Formula | C21H18N2O7 |
|---|---|
| Molecular Weight | 410.11 g/mol |
| LogP | 4.2924 |
| Topological Polar Surface Area | 120.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 410.1114 |
| Heavy Atoms | 30 |
| Complexity | 1086.9893 |
Chemical Identifiers
| CAS Number | 890645-39-3 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=C(O2)C3=C(C=C(C=C3)OC)[N+](=O)[O-] |
Product Overview
Ethyl 4-(5-(4-methoxy-2-nitrophenyl)furan-2-carboxamido)benzoate (CAS 890645-39-3), with molecular formula C21H18N2O7 and molecular weight 410.11 g/mol. IUPAC: ethyl 4-[[5-(4-methoxy-2-nitrophenyl)furan-2-carbonyl]amino]benzoate.
Chemical Property Profile of Ethyl 4-(5-(4-methoxy-2-nitrophenyl)furan-2-carboxamido)benzoate
Property Insights of Ethyl 4-(5-(4-methoxy-2-nitrophenyl)furan-2-carboxamido)benzoate
The XLogP value of 4.2924 indicates that Ethyl 4-(5-(4-methoxy-2-nitrophenyl)furan-2-carboxamido)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 120.91 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 4-(5-(4-methoxy-2-nitrophenyl)furan-2-carboxamido)benzoate. Following Lipinski's Rule of Five, Ethyl 4-(5-(4-methoxy-2-nitrophenyl)furan-2-carboxamido)benzoate has 1 hydrogen bond donor(s) and 7 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 Ethyl 4-(5-(4-methoxy-2-nitrophenyl)furan-2-carboxamido)benzoate?
The CAS number of Ethyl 4-(5-(4-methoxy-2-nitrophenyl)furan-2-carboxamido)benzoate is 890645-39-3.
What is the molecular formula of Ethyl 4-(5-(4-methoxy-2-nitrophenyl)furan-2-carboxamido)benzoate?
The molecular formula of Ethyl 4-(5-(4-methoxy-2-nitrophenyl)furan-2-carboxamido)benzoate is C21H18N2O7.
What is the molecular weight of Ethyl 4-(5-(4-methoxy-2-nitrophenyl)furan-2-carboxamido)benzoate?
The molecular weight of Ethyl 4-(5-(4-methoxy-2-nitrophenyl)furan-2-carboxamido)benzoate is 410.11 g/mol.
Where can I buy Ethyl 4-(5-(4-methoxy-2-nitrophenyl)furan-2-carboxamido)benzoate?
You can request a quote for Ethyl 4-(5-(4-methoxy-2-nitrophenyl)furan-2-carboxamido)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 4-(5-(4-methoxy-2-nitrophenyl)furan-2-carboxamido)benzoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-(5-(4-methoxy-2-nitrophenyl)furan-2-carboxamido)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.