1,4-Bis-(acetoacetyl)-piperazine
TL;DR: 1,4-Bis-(acetoacetyl)-piperazine (CAS 92538-64-2) is a chemical compound with molecular formula C12H18N2O4 and molecular weight 254.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-(3-oxobutanoyl)piperazin-1-yl]butane-1,3-dione
Also Known As: Piperazine, 1,4-bis(1,3-dioxobutyl)-, 1,1'-(Piperazine-1,4-diyl)bis(butane-1,3-dione), 1-[4-(3-oxobutanoyl)piperazin-1-yl]butane-1,3-dione, 1,4-BIS-(ACETOACETYL)-PIPERAZINE, 1,1'-(Piperazine-1,4-diyl)di(butane-1,3-dione)
| Molecular Formula | C12H18N2O4 |
|---|---|
| Molecular Weight | 254.13 g/mol |
| LogP | -1.3 |
| Topological Polar Surface Area | 74.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 254.12666 |
| Heavy Atoms | 18 |
| Complexity | 334.0 |
Chemical Identifiers
| CAS Number | 92538-64-2 |
|---|---|
| SMILES | CC(=O)CC(=O)N1CCN(CC1)C(=O)CC(=O)C |
| InChIKey | BMBXDBNMQGCKMJ-UHFFFAOYSA-N |
Product Overview
1,4-Bis-(acetoacetyl)-piperazine (CAS 92538-64-2), with molecular formula C12H18N2O4 and molecular weight 254.13 g/mol. IUPAC: 1-[4-(3-oxobutanoyl)piperazin-1-yl]butane-1,3-dione.
Chemical Property Profile of 1,4-Bis-(acetoacetyl)-piperazine
Property Insights of 1,4-Bis-(acetoacetyl)-piperazine
The XLogP value of -1.3 indicates that 1,4-Bis-(acetoacetyl)-piperazine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 74.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,4-Bis-(acetoacetyl)-piperazine. Following Lipinski's Rule of Five, 1,4-Bis-(acetoacetyl)-piperazine has 0 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 1,4-Bis-(acetoacetyl)-piperazine?
The CAS number of 1,4-Bis-(acetoacetyl)-piperazine is 92538-64-2.
What is the molecular formula of 1,4-Bis-(acetoacetyl)-piperazine?
The molecular formula of 1,4-Bis-(acetoacetyl)-piperazine is C12H18N2O4.
What is the molecular weight of 1,4-Bis-(acetoacetyl)-piperazine?
The molecular weight of 1,4-Bis-(acetoacetyl)-piperazine is 254.13 g/mol.
Where can I buy 1,4-Bis-(acetoacetyl)-piperazine?
You can request a quote for 1,4-Bis-(acetoacetyl)-piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Bis-(acetoacetyl)-piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Bis-(acetoacetyl)-piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.