diethyl 2-(furan-2-yl)-6-methyl-4-(phenylamino)cyclohexa-3,5-diene-1,3-dicarboxylate
TL;DR: diethyl 2-(furan-2-yl)-6-methyl-4-(phenylamino)cyclohexa-3,5-diene-1,3-dicarboxylate (CAS 161265-94-7) is a chemical compound with molecular formula C23H25NO5 and molecular weight 395.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 4-anilino-2-(furan-2-yl)-6-methylcyclohexa-3,5-diene-1,3-dicarboxylate
Also Known As: diethyl 2-(furan-2-yl)-6-methyl-4-(phenylamino)cyclohexa-3,5-diene-1,3-dicarboxylate, diethyl 4-anilino-2-(furan-2-yl)-6-methylcyclohexa-3,5-diene-1,3-dicarboxylate
| Molecular Formula | C23H25NO5 |
|---|---|
| Molecular Weight | 395.17 g/mol |
| LogP | 4.4317 |
| Topological Polar Surface Area | 77.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 395.17328 |
| Heavy Atoms | 29 |
| Complexity | 912.0095 |
Chemical Identifiers
| CAS Number | 161265-94-7 |
|---|---|
| SMILES | CCOC(=O)C1C(C(=C(C=C1C)NC2=CC=CC=C2)C(=O)OCC)C3=CC=CO3 |
Product Overview
diethyl 2-(furan-2-yl)-6-methyl-4-(phenylamino)cyclohexa-3,5-diene-1,3-dicarboxylate (CAS 161265-94-7), with molecular formula C23H25NO5 and molecular weight 395.17 g/mol. IUPAC: diethyl 4-anilino-2-(furan-2-yl)-6-methylcyclohexa-3,5-diene-1,3-dicarboxylate.
Chemical Property Profile of diethyl 2-(furan-2-yl)-6-methyl-4-(phenylamino)cyclohexa-3,5-diene-1,3-dicarboxylate
Property Insights of diethyl 2-(furan-2-yl)-6-methyl-4-(phenylamino)cyclohexa-3,5-diene-1,3-dicarboxylate
The XLogP value of 4.4317 indicates that diethyl 2-(furan-2-yl)-6-methyl-4-(phenylamino)cyclohexa-3,5-diene-1,3-dicarboxylate 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 2-(furan-2-yl)-6-methyl-4-(phenylamino)cyclohexa-3,5-diene-1,3-dicarboxylate. Following Lipinski's Rule of Five, diethyl 2-(furan-2-yl)-6-methyl-4-(phenylamino)cyclohexa-3,5-diene-1,3-dicarboxylate 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 2-(furan-2-yl)-6-methyl-4-(phenylamino)cyclohexa-3,5-diene-1,3-dicarboxylate?
The CAS number of diethyl 2-(furan-2-yl)-6-methyl-4-(phenylamino)cyclohexa-3,5-diene-1,3-dicarboxylate is 161265-94-7.
What is the molecular formula of diethyl 2-(furan-2-yl)-6-methyl-4-(phenylamino)cyclohexa-3,5-diene-1,3-dicarboxylate?
The molecular formula of diethyl 2-(furan-2-yl)-6-methyl-4-(phenylamino)cyclohexa-3,5-diene-1,3-dicarboxylate is C23H25NO5.
What is the molecular weight of diethyl 2-(furan-2-yl)-6-methyl-4-(phenylamino)cyclohexa-3,5-diene-1,3-dicarboxylate?
The molecular weight of diethyl 2-(furan-2-yl)-6-methyl-4-(phenylamino)cyclohexa-3,5-diene-1,3-dicarboxylate is 395.17 g/mol.
Where can I buy diethyl 2-(furan-2-yl)-6-methyl-4-(phenylamino)cyclohexa-3,5-diene-1,3-dicarboxylate?
You can request a quote for diethyl 2-(furan-2-yl)-6-methyl-4-(phenylamino)cyclohexa-3,5-diene-1,3-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for diethyl 2-(furan-2-yl)-6-methyl-4-(phenylamino)cyclohexa-3,5-diene-1,3-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for diethyl 2-(furan-2-yl)-6-methyl-4-(phenylamino)cyclohexa-3,5-diene-1,3-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.