![(3E)-3-[2-(4-methoxyphenyl)-2-oxoethylidene]piperazin-2-one structure](/static/products/6365/63656-22-4.webp)
(3E)-3-[2-(4-methoxyphenyl)-2-oxoethylidene]piperazin-2-one
TL;DR: (3E)-3-[2-(4-methoxyphenyl)-2-oxoethylidene]piperazin-2-one (CAS 63656-22-4) is a chemical compound with molecular formula C13H14N2O3 and molecular weight 246.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3E)-3-[2-(4-methoxyphenyl)-2-oxoethylidene]piperazin-2-one
Also Known As: (3E)-3-[2-(4-methoxyphenyl)-2-oxoethylidene]piperazin-2-one, AF-407/08339044, 3-[2-(4-methoxyphenyl)-2-oxoethylidene]-2-piperazinone, (E)-3-(2-(4-methoxyphenyl)-2-oxoethylidene)piperazin-2-one
| Molecular Formula | C13H14N2O3 |
|---|---|
| Molecular Weight | 246.10 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 67.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 246.10045 |
| Heavy Atoms | 18 |
| Complexity | 357.0 |
Chemical Identifiers
| CAS Number | 63656-22-4 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C(=O)/C=C/2\C(=O)NCCN2 |
| InChIKey | UDQYKAJATPOXHR-DHZHZOJOSA-N |
Product Overview
(3E)-3-[2-(4-methoxyphenyl)-2-oxoethylidene]piperazin-2-one (CAS 63656-22-4), with molecular formula C13H14N2O3 and molecular weight 246.10 g/mol. IUPAC: (3E)-3-[2-(4-methoxyphenyl)-2-oxoethylidene]piperazin-2-one.
Chemical Property Profile of (3E)-3-[2-(4-methoxyphenyl)-2-oxoethylidene]piperazin-2-one
Property Insights of (3E)-3-[2-(4-methoxyphenyl)-2-oxoethylidene]piperazin-2-one
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3E)-3-[2-(4-methoxyphenyl)-2-oxoethylidene]piperazin-2-one. The TPSA of 67.4 Ų falls within the moderate polarity range, balancing permeability and solubility for (3E)-3-[2-(4-methoxyphenyl)-2-oxoethylidene]piperazin-2-one. Following Lipinski's Rule of Five, (3E)-3-[2-(4-methoxyphenyl)-2-oxoethylidene]piperazin-2-one has 2 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 (3E)-3-[2-(4-methoxyphenyl)-2-oxoethylidene]piperazin-2-one?
The CAS number of (3E)-3-[2-(4-methoxyphenyl)-2-oxoethylidene]piperazin-2-one is 63656-22-4.
What is the molecular formula of (3E)-3-[2-(4-methoxyphenyl)-2-oxoethylidene]piperazin-2-one?
The molecular formula of (3E)-3-[2-(4-methoxyphenyl)-2-oxoethylidene]piperazin-2-one is C13H14N2O3.
What is the molecular weight of (3E)-3-[2-(4-methoxyphenyl)-2-oxoethylidene]piperazin-2-one?
The molecular weight of (3E)-3-[2-(4-methoxyphenyl)-2-oxoethylidene]piperazin-2-one is 246.10 g/mol.
Where can I buy (3E)-3-[2-(4-methoxyphenyl)-2-oxoethylidene]piperazin-2-one?
You can request a quote for (3E)-3-[2-(4-methoxyphenyl)-2-oxoethylidene]piperazin-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3E)-3-[2-(4-methoxyphenyl)-2-oxoethylidene]piperazin-2-one?
Yes, KEHONG BIO provides custom synthesis services for (3E)-3-[2-(4-methoxyphenyl)-2-oxoethylidene]piperazin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.