1,4-Dibenzyl-2,5-piperazinedione
TL;DR: 1,4-Dibenzyl-2,5-piperazinedione (CAS 42492-87-5) is a chemical compound with molecular formula C18H18N2O2 and molecular weight 294.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4-dibenzylpiperazine-2,5-dione
Also Known As: 1,4-dibenzylpiperazine-2,5-dione, 1,4-Dibenzyl-piperazine-2,5-dione, 1,4-dibenzyl-2,5-piperazinedione, 1,4-bis(phenylmethyl)piperazine-2,5-dione, 2,5-Piperazinedione, 1,4-bis(phenylmethyl)-
| Molecular Formula | C18H18N2O2 |
|---|---|
| Molecular Weight | 294.14 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 40.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 294.13684 |
| Heavy Atoms | 22 |
| Complexity | 360.0 |
Chemical Identifiers
| CAS Number | 42492-87-5 |
|---|---|
| SMILES | C1C(=O)N(CC(=O)N1CC2=CC=CC=C2)CC3=CC=CC=C3 |
| InChIKey | IQRPFFBYORNALN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,4-Dibenzyl-2,5-piperazinedione (CAS 42492-87-5), with molecular formula C18H18N2O2 and molecular weight 294.14 g/mol. IUPAC: 1,4-dibenzylpiperazine-2,5-dione.
Chemical Property Profile of 1,4-Dibenzyl-2,5-piperazinedione
Property Insights of 1,4-Dibenzyl-2,5-piperazinedione
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,4-Dibenzyl-2,5-piperazinedione. With a topological polar surface area (TPSA) of 40.6 Ų, 1,4-Dibenzyl-2,5-piperazinedione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Dibenzyl-2,5-piperazinedione has 0 hydrogen bond donor(s) and 2 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-Dibenzyl-2,5-piperazinedione?
The CAS number of 1,4-Dibenzyl-2,5-piperazinedione is 42492-87-5.
What is the molecular formula of 1,4-Dibenzyl-2,5-piperazinedione?
The molecular formula of 1,4-Dibenzyl-2,5-piperazinedione is C18H18N2O2.
What is the molecular weight of 1,4-Dibenzyl-2,5-piperazinedione?
The molecular weight of 1,4-Dibenzyl-2,5-piperazinedione is 294.14 g/mol.
Where can I buy 1,4-Dibenzyl-2,5-piperazinedione?
You can request a quote for 1,4-Dibenzyl-2,5-piperazinedione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Dibenzyl-2,5-piperazinedione?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Dibenzyl-2,5-piperazinedione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.