Piperazinone, 3-(2-oxo-2-phenylethylidene)-
TL;DR: Piperazinone, 3-(2-oxo-2-phenylethylidene)- (CAS 1164534-36-4) is a chemical compound with molecular formula C12H12N2O2 and molecular weight 216.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3Z)-3-phenacylidenepiperazin-2-one
Also Known As: 3-(2-Oxo-2-phenylethylidene)piperazinone, (3Z)-3-phenacylidenepiperazin-2-one, Piperazinone, 3-(2-oxo-2-phenylethylidene)-, 3-(2-oxo-2-phenylethylidene)-2-piperazinone, 3-(2-oxo-2-phenylethylidene)piperazin-2-one
| Molecular Formula | C12H12N2O2 |
|---|---|
| Molecular Weight | 216.09 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 216.08987 |
| Heavy Atoms | 16 |
| Complexity | 317.0 |
Chemical Identifiers
| CAS Number | 1164534-36-4 |
|---|---|
| SMILES | C1CNC(=O)/C(=C/C(=O)C2=CC=CC=C2)/N1 |
| InChIKey | RLNGHWOGDGZTQI-NTMALXAHSA-N |
Product Overview
Piperazinone, 3-(2-oxo-2-phenylethylidene)- (CAS 1164534-36-4), with molecular formula C12H12N2O2 and molecular weight 216.09 g/mol. IUPAC: (3Z)-3-phenacylidenepiperazin-2-one.
Chemical Property Profile of Piperazinone, 3-(2-oxo-2-phenylethylidene)-
Property Insights of Piperazinone, 3-(2-oxo-2-phenylethylidene)-
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Piperazinone, 3-(2-oxo-2-phenylethylidene)-. With a topological polar surface area (TPSA) of 58.2 Ų, Piperazinone, 3-(2-oxo-2-phenylethylidene)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Piperazinone, 3-(2-oxo-2-phenylethylidene)- has 2 hydrogen bond donor(s) and 3 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 Piperazinone, 3-(2-oxo-2-phenylethylidene)-?
The CAS number of Piperazinone, 3-(2-oxo-2-phenylethylidene)- is 1164534-36-4.
What is the molecular formula of Piperazinone, 3-(2-oxo-2-phenylethylidene)-?
The molecular formula of Piperazinone, 3-(2-oxo-2-phenylethylidene)- is C12H12N2O2.
What is the molecular weight of Piperazinone, 3-(2-oxo-2-phenylethylidene)-?
The molecular weight of Piperazinone, 3-(2-oxo-2-phenylethylidene)- is 216.09 g/mol.
Where can I buy Piperazinone, 3-(2-oxo-2-phenylethylidene)-?
You can request a quote for Piperazinone, 3-(2-oxo-2-phenylethylidene)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Piperazinone, 3-(2-oxo-2-phenylethylidene)-?
Yes, KEHONG BIO provides custom synthesis services for Piperazinone, 3-(2-oxo-2-phenylethylidene)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.