1-Acetyl-3-[(4-methoxyphenyl)methylidene]piperazine-2,5-dione
TL;DR: 1-Acetyl-3-[(4-methoxyphenyl)methylidene]piperazine-2,5-dione (CAS 74720-30-2) is a chemical compound with molecular formula C14H14N2O4 and molecular weight 274.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-acetyl-3-[(4-methoxyphenyl)methylidene]piperazine-2,5-dione
Also Known As: 1-acetyl-3-[(4-methoxyphenyl)methylidene]piperazine-2,5-dione, 1-acetyl-3-[(4-methoxyphenyl)methylene]tetrahydro-2,5-pyrazinedione
| Molecular Formula | C14H14N2O4 |
|---|---|
| Molecular Weight | 274.10 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 75.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 274.09537 |
| Heavy Atoms | 20 |
| Complexity | 450.0 |
Chemical Identifiers
| CAS Number | 74720-30-2 |
|---|---|
| SMILES | CC(=O)N1CC(=O)NC(=CC2=CC=C(C=C2)OC)C1=O |
| InChIKey | DHTWSXQNUMZDAD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Acetyl-3-[(4-methoxyphenyl)methylidene]piperazine-2,5-dione (CAS 74720-30-2), with molecular formula C14H14N2O4 and molecular weight 274.10 g/mol. IUPAC: 1-acetyl-3-[(4-methoxyphenyl)methylidene]piperazine-2,5-dione.
Chemical Property Profile of 1-Acetyl-3-[(4-methoxyphenyl)methylidene]piperazine-2,5-dione
Property Insights of 1-Acetyl-3-[(4-methoxyphenyl)methylidene]piperazine-2,5-dione
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Acetyl-3-[(4-methoxyphenyl)methylidene]piperazine-2,5-dione. The TPSA of 75.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Acetyl-3-[(4-methoxyphenyl)methylidene]piperazine-2,5-dione. Following Lipinski's Rule of Five, 1-Acetyl-3-[(4-methoxyphenyl)methylidene]piperazine-2,5-dione 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 1-Acetyl-3-[(4-methoxyphenyl)methylidene]piperazine-2,5-dione?
The CAS number of 1-Acetyl-3-[(4-methoxyphenyl)methylidene]piperazine-2,5-dione is 74720-30-2.
What is the molecular formula of 1-Acetyl-3-[(4-methoxyphenyl)methylidene]piperazine-2,5-dione?
The molecular formula of 1-Acetyl-3-[(4-methoxyphenyl)methylidene]piperazine-2,5-dione is C14H14N2O4.
What is the molecular weight of 1-Acetyl-3-[(4-methoxyphenyl)methylidene]piperazine-2,5-dione?
The molecular weight of 1-Acetyl-3-[(4-methoxyphenyl)methylidene]piperazine-2,5-dione is 274.10 g/mol.
Where can I buy 1-Acetyl-3-[(4-methoxyphenyl)methylidene]piperazine-2,5-dione?
You can request a quote for 1-Acetyl-3-[(4-methoxyphenyl)methylidene]piperazine-2,5-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Acetyl-3-[(4-methoxyphenyl)methylidene]piperazine-2,5-dione?
Yes, KEHONG BIO provides custom synthesis services for 1-Acetyl-3-[(4-methoxyphenyl)methylidene]piperazine-2,5-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.