3-(4-Ethoxyanilino)-5-(furan-2-yl)cyclohex-2-en-1-one
TL;DR: 3-(4-Ethoxyanilino)-5-(furan-2-yl)cyclohex-2-en-1-one (CAS 351013-80-4) is a chemical compound with molecular formula C18H19NO3 and molecular weight 297.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-ethoxyanilino)-5-(furan-2-yl)cyclohex-2-en-1-one
Also Known As: BAS 01849663, 3-(4-ethoxyanilino)-5-(furan-2-yl)cyclohex-2-en-1-one, 3-(4-ethoxyanilino)-5-(2-furyl)-2-cyclohexen-1-one, 3-((4-ethoxyphenyl)amino)-5-(furan-2-yl)cyclohex-2-enone, 3-(4-Ethoxy-phenylamino)-5-furan-2-yl-cyclohex-2-enone
| Molecular Formula | C18H19NO3 |
|---|---|
| Molecular Weight | 297.14 g/mol |
| LogP | 4.1208 |
| Topological Polar Surface Area | 51.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 297.1365 |
| Heavy Atoms | 22 |
| Complexity | 656.1505 |
Chemical Identifiers
| CAS Number | 351013-80-4 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)NC2=CC(=O)CC(C2)C3=CC=CO3 |
Product Overview
3-(4-Ethoxyanilino)-5-(furan-2-yl)cyclohex-2-en-1-one (CAS 351013-80-4), with molecular formula C18H19NO3 and molecular weight 297.14 g/mol. IUPAC: 3-(4-ethoxyanilino)-5-(furan-2-yl)cyclohex-2-en-1-one.
Chemical Property Profile of 3-(4-Ethoxyanilino)-5-(furan-2-yl)cyclohex-2-en-1-one
Property Insights of 3-(4-Ethoxyanilino)-5-(furan-2-yl)cyclohex-2-en-1-one
The XLogP value of 4.1208 indicates that 3-(4-Ethoxyanilino)-5-(furan-2-yl)cyclohex-2-en-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.47 Ų, 3-(4-Ethoxyanilino)-5-(furan-2-yl)cyclohex-2-en-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-Ethoxyanilino)-5-(furan-2-yl)cyclohex-2-en-1-one has 1 hydrogen bond donor(s) and 4 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 3-(4-Ethoxyanilino)-5-(furan-2-yl)cyclohex-2-en-1-one?
The CAS number of 3-(4-Ethoxyanilino)-5-(furan-2-yl)cyclohex-2-en-1-one is 351013-80-4.
What is the molecular formula of 3-(4-Ethoxyanilino)-5-(furan-2-yl)cyclohex-2-en-1-one?
The molecular formula of 3-(4-Ethoxyanilino)-5-(furan-2-yl)cyclohex-2-en-1-one is C18H19NO3.
What is the molecular weight of 3-(4-Ethoxyanilino)-5-(furan-2-yl)cyclohex-2-en-1-one?
The molecular weight of 3-(4-Ethoxyanilino)-5-(furan-2-yl)cyclohex-2-en-1-one is 297.14 g/mol.
Where can I buy 3-(4-Ethoxyanilino)-5-(furan-2-yl)cyclohex-2-en-1-one?
You can request a quote for 3-(4-Ethoxyanilino)-5-(furan-2-yl)cyclohex-2-en-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-Ethoxyanilino)-5-(furan-2-yl)cyclohex-2-en-1-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Ethoxyanilino)-5-(furan-2-yl)cyclohex-2-en-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.