(E)-ethyl 2-(1-cinnamyl-3-oxopiperazin-2-yl)acetate
TL;DR: (E)-ethyl 2-(1-cinnamyl-3-oxopiperazin-2-yl)acetate (CAS 1007929-44-3) is a chemical compound with molecular formula C17H22N2O3 and molecular weight 302.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[3-oxo-1-[(E)-3-phenylprop-2-enyl]piperazin-2-yl]acetate
Also Known As: BAS 12252563, VU0494455-1, (E)-ethyl 2-(1-cinnamyl-3-oxopiperazin-2-yl)acetate, ETHYL 2-{3-OXO-1-[(2E)-3-PHENYLPROP-2-EN-1-YL]PIPERAZIN-2-YL}ACETATE, F1723-0134
| Molecular Formula | C17H22N2O3 |
|---|---|
| Molecular Weight | 302.16 g/mol |
| LogP | 1.4534 |
| Topological Polar Surface Area | 58.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 302.16306 |
| Heavy Atoms | 22 |
| Complexity | 527.9654 |
Chemical Identifiers
| CAS Number | 1007929-44-3 |
|---|---|
| SMILES | CCOC(=O)CC1C(=O)NCCN1C/C=C/C2=CC=CC=C2 |
Product Overview
(E)-ethyl 2-(1-cinnamyl-3-oxopiperazin-2-yl)acetate (CAS 1007929-44-3), with molecular formula C17H22N2O3 and molecular weight 302.16 g/mol. IUPAC: ethyl 2-[3-oxo-1-[(E)-3-phenylprop-2-enyl]piperazin-2-yl]acetate.
Chemical Property Profile of (E)-ethyl 2-(1-cinnamyl-3-oxopiperazin-2-yl)acetate
Property Insights of (E)-ethyl 2-(1-cinnamyl-3-oxopiperazin-2-yl)acetate
The XLogP value of 1.4534 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-ethyl 2-(1-cinnamyl-3-oxopiperazin-2-yl)acetate. With a topological polar surface area (TPSA) of 58.64 Ų, (E)-ethyl 2-(1-cinnamyl-3-oxopiperazin-2-yl)acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-ethyl 2-(1-cinnamyl-3-oxopiperazin-2-yl)acetate 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 (E)-ethyl 2-(1-cinnamyl-3-oxopiperazin-2-yl)acetate?
The CAS number of (E)-ethyl 2-(1-cinnamyl-3-oxopiperazin-2-yl)acetate is 1007929-44-3.
What is the molecular formula of (E)-ethyl 2-(1-cinnamyl-3-oxopiperazin-2-yl)acetate?
The molecular formula of (E)-ethyl 2-(1-cinnamyl-3-oxopiperazin-2-yl)acetate is C17H22N2O3.
What is the molecular weight of (E)-ethyl 2-(1-cinnamyl-3-oxopiperazin-2-yl)acetate?
The molecular weight of (E)-ethyl 2-(1-cinnamyl-3-oxopiperazin-2-yl)acetate is 302.16 g/mol.
Where can I buy (E)-ethyl 2-(1-cinnamyl-3-oxopiperazin-2-yl)acetate?
You can request a quote for (E)-ethyl 2-(1-cinnamyl-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 (E)-ethyl 2-(1-cinnamyl-3-oxopiperazin-2-yl)acetate?
Yes, KEHONG BIO provides custom synthesis services for (E)-ethyl 2-(1-cinnamyl-3-oxopiperazin-2-yl)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.