Methyl 2-cyano-3-(5-(3-nitrophenyl)-2-furyl)-2-propenoate
TL;DR: Methyl 2-cyano-3-(5-(3-nitrophenyl)-2-furyl)-2-propenoate (CAS 853347-75-8) is a chemical compound with molecular formula C15H10N2O5 and molecular weight 298.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (E)-2-cyano-3-[5-(3-nitrophenyl)furan-2-yl]prop-2-enoate
Also Known As: METHYL 2-CYANO-3-(5-(3-NITROPHENYL)-2-FURYL)-2-PROPENOATE, Methyl 2-cyano-3-(5-(3-nitrophenyl)furan-2-yl)acrylate, Methyl 2-cyano-3-[5-(3-nitrophenyl)-2-furyl]prop-2-enoate, methyl (E)-2-cyano-3-[5-(3-nitrophenyl)furan-2-yl]prop-2-enoate, 662-635-5
| Molecular Formula | C15H10N2O5 |
|---|---|
| Molecular Weight | 298.06 g/mol |
| LogP | 2.93478 |
| Topological Polar Surface Area | 106.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 298.05896 |
| Heavy Atoms | 22 |
| Complexity | 798.2593 |
Chemical Identifiers
| CAS Number | 853347-75-8 |
|---|---|
| SMILES | COC(=O)/C(=C/C1=CC=C(O1)C2=CC(=CC=C2)[N+](=O)[O-])/C#N |
Product Overview
Methyl 2-cyano-3-(5-(3-nitrophenyl)-2-furyl)-2-propenoate (CAS 853347-75-8), with molecular formula C15H10N2O5 and molecular weight 298.06 g/mol. IUPAC: methyl (E)-2-cyano-3-[5-(3-nitrophenyl)furan-2-yl]prop-2-enoate.
Chemical Property Profile of Methyl 2-cyano-3-(5-(3-nitrophenyl)-2-furyl)-2-propenoate
Property Insights of Methyl 2-cyano-3-(5-(3-nitrophenyl)-2-furyl)-2-propenoate
The XLogP value of 2.93478 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-cyano-3-(5-(3-nitrophenyl)-2-furyl)-2-propenoate. The TPSA of 106.37 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-cyano-3-(5-(3-nitrophenyl)-2-furyl)-2-propenoate. Following Lipinski's Rule of Five, Methyl 2-cyano-3-(5-(3-nitrophenyl)-2-furyl)-2-propenoate 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 Methyl 2-cyano-3-(5-(3-nitrophenyl)-2-furyl)-2-propenoate?
The CAS number of Methyl 2-cyano-3-(5-(3-nitrophenyl)-2-furyl)-2-propenoate is 853347-75-8.
What is the molecular formula of Methyl 2-cyano-3-(5-(3-nitrophenyl)-2-furyl)-2-propenoate?
The molecular formula of Methyl 2-cyano-3-(5-(3-nitrophenyl)-2-furyl)-2-propenoate is C15H10N2O5.
What is the molecular weight of Methyl 2-cyano-3-(5-(3-nitrophenyl)-2-furyl)-2-propenoate?
The molecular weight of Methyl 2-cyano-3-(5-(3-nitrophenyl)-2-furyl)-2-propenoate is 298.06 g/mol.
Where can I buy Methyl 2-cyano-3-(5-(3-nitrophenyl)-2-furyl)-2-propenoate?
You can request a quote for Methyl 2-cyano-3-(5-(3-nitrophenyl)-2-furyl)-2-propenoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-cyano-3-(5-(3-nitrophenyl)-2-furyl)-2-propenoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-cyano-3-(5-(3-nitrophenyl)-2-furyl)-2-propenoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.