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Ethyl [1-(furan-3-ylmethyl)-3-oxopiperazin-2-yl]acetate
TL;DR: Ethyl [1-(furan-3-ylmethyl)-3-oxopiperazin-2-yl]acetate (CAS 1008015-51-7) is a chemical compound with molecular formula C13H18N2O4 and molecular weight 266.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[1-(furan-3-ylmethyl)-3-oxopiperazin-2-yl]acetate
Also Known As: BAS 12633519, VU0507752-1, ethyl [1-(3-furylmethyl)-3-oxo-2-piperazinyl]acetate, ethyl [1-(furan-3-ylmethyl)-3-oxopiperazin-2-yl]acetate, BRD-A78295260-001-01-3
| Molecular Formula | C13H18N2O4 |
|---|---|
| Molecular Weight | 266.13 g/mol |
| LogP | 0.5332 |
| Topological Polar Surface Area | 71.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 266.12665 |
| Heavy Atoms | 19 |
| Complexity | 429.86142 |
Chemical Identifiers
| CAS Number | 1008015-51-7 |
|---|---|
| SMILES | CCOC(=O)CC1C(=O)NCCN1CC2=COC=C2 |
Product Overview
Ethyl [1-(furan-3-ylmethyl)-3-oxopiperazin-2-yl]acetate (CAS 1008015-51-7), with molecular formula C13H18N2O4 and molecular weight 266.13 g/mol. IUPAC: ethyl 2-[1-(furan-3-ylmethyl)-3-oxopiperazin-2-yl]acetate.
Chemical Property Profile of Ethyl [1-(furan-3-ylmethyl)-3-oxopiperazin-2-yl]acetate
Property Insights of Ethyl [1-(furan-3-ylmethyl)-3-oxopiperazin-2-yl]acetate
The XLogP value of 0.5332 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl [1-(furan-3-ylmethyl)-3-oxopiperazin-2-yl]acetate. The TPSA of 71.78 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl [1-(furan-3-ylmethyl)-3-oxopiperazin-2-yl]acetate. Following Lipinski's Rule of Five, Ethyl [1-(furan-3-ylmethyl)-3-oxopiperazin-2-yl]acetate has 1 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 Ethyl [1-(furan-3-ylmethyl)-3-oxopiperazin-2-yl]acetate?
The CAS number of Ethyl [1-(furan-3-ylmethyl)-3-oxopiperazin-2-yl]acetate is 1008015-51-7.
What is the molecular formula of Ethyl [1-(furan-3-ylmethyl)-3-oxopiperazin-2-yl]acetate?
The molecular formula of Ethyl [1-(furan-3-ylmethyl)-3-oxopiperazin-2-yl]acetate is C13H18N2O4.
What is the molecular weight of Ethyl [1-(furan-3-ylmethyl)-3-oxopiperazin-2-yl]acetate?
The molecular weight of Ethyl [1-(furan-3-ylmethyl)-3-oxopiperazin-2-yl]acetate is 266.13 g/mol.
Where can I buy Ethyl [1-(furan-3-ylmethyl)-3-oxopiperazin-2-yl]acetate?
You can request a quote for Ethyl [1-(furan-3-ylmethyl)-3-oxopiperazin-2-yl]acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl [1-(furan-3-ylmethyl)-3-oxopiperazin-2-yl]acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl [1-(furan-3-ylmethyl)-3-oxopiperazin-2-yl]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.