trans-2,4-Dibenzoylpiperazine
TL;DR: trans-2,4-Dibenzoylpiperazine (CAS 66975-05-1) is a chemical compound with molecular formula C20H22N2O2 and molecular weight 322.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2S,5R)-4-benzoyl-2,5-dimethylpiperazin-1-yl]-phenylmethanone
Also Known As: trans-2,4-dibenzoylpiperazine, trans-2,5-Dimethyl-1,4-dibenzoylpiperazine, Piperazine,4-dibenzoyl-2,5-dimethyl-, trans-, Piperazine, 1,4-dibenzoyl-2,5-dimethyl-, trans-, [(2S,5R)-4-benzoyl-2,5-dimethylpiperazin-1-yl]-phenylmethanone
| Molecular Formula | C20H22N2O2 |
|---|---|
| Molecular Weight | 322.17 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 40.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 322.16812 |
| Heavy Atoms | 24 |
| Complexity | 411.0 |
Chemical Identifiers
| CAS Number | 66975-05-1 |
|---|---|
| SMILES | C[C@@H]1CN([C@H](CN1C(=O)C2=CC=CC=C2)C)C(=O)C3=CC=CC=C3 |
| InChIKey | HMEKMMQTCKTXIA-IYBDPMFKSA-N |
Product Overview
trans-2,4-Dibenzoylpiperazine (CAS 66975-05-1), with molecular formula C20H22N2O2 and molecular weight 322.17 g/mol. IUPAC: [(2S,5R)-4-benzoyl-2,5-dimethylpiperazin-1-yl]-phenylmethanone.
Chemical Property Profile of trans-2,4-Dibenzoylpiperazine
Property Insights of trans-2,4-Dibenzoylpiperazine
The XLogP value of 3.2 indicates that trans-2,4-Dibenzoylpiperazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.6 Ų, trans-2,4-Dibenzoylpiperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, trans-2,4-Dibenzoylpiperazine 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 trans-2,4-Dibenzoylpiperazine?
The CAS number of trans-2,4-Dibenzoylpiperazine is 66975-05-1.
What is the molecular formula of trans-2,4-Dibenzoylpiperazine?
The molecular formula of trans-2,4-Dibenzoylpiperazine is C20H22N2O2.
What is the molecular weight of trans-2,4-Dibenzoylpiperazine?
The molecular weight of trans-2,4-Dibenzoylpiperazine is 322.17 g/mol.
Where can I buy trans-2,4-Dibenzoylpiperazine?
You can request a quote for trans-2,4-Dibenzoylpiperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for trans-2,4-Dibenzoylpiperazine?
Yes, KEHONG BIO provides custom synthesis services for trans-2,4-Dibenzoylpiperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.