2,6-Piperazinedione, 4-benzyl-1-(3-chloro-4-methylphenyl)-
TL;DR: 2,6-Piperazinedione, 4-benzyl-1-(3-chloro-4-methylphenyl)- (CAS 13480-13-2) is a chemical compound with molecular formula C18H17ClN2O2 and molecular weight 328.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-benzyl-1-(3-chloro-4-methylphenyl)piperazine-2,6-dione
Also Known As: 2,6-Piperazinedione, 4-benzyl-1-(3-chloro-4-methylphenyl)-, 5-24-05-00311 (Beilstein Handbook Reference), 1-Benzyl-4-(3-chloro-4-methylphenyl)-3,5-diketopiperazine, 4-benzyl-1-(3-chloro-4-methylphenyl)piperazine-2,6-dione, 1-(3-Chloro-p-tolyl)-4-benzyl-2,6-piperazinedione
| Molecular Formula | C18H17ClN2O2 |
|---|---|
| Molecular Weight | 328.10 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 40.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 328.09787 |
| Heavy Atoms | 23 |
| Complexity | 432.0 |
Chemical Identifiers
| CAS Number | 13480-13-2 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)N2C(=O)CN(CC2=O)CC3=CC=CC=C3)Cl |
| InChIKey | QCJXRCGKGMUOEV-UHFFFAOYSA-N |
Product Overview
2,6-Piperazinedione, 4-benzyl-1-(3-chloro-4-methylphenyl)- (CAS 13480-13-2), with molecular formula C18H17ClN2O2 and molecular weight 328.10 g/mol. IUPAC: 4-benzyl-1-(3-chloro-4-methylphenyl)piperazine-2,6-dione.
Chemical Property Profile of 2,6-Piperazinedione, 4-benzyl-1-(3-chloro-4-methylphenyl)-
Property Insights of 2,6-Piperazinedione, 4-benzyl-1-(3-chloro-4-methylphenyl)-
The XLogP value of 3.4 indicates that 2,6-Piperazinedione, 4-benzyl-1-(3-chloro-4-methylphenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.6 Ų, 2,6-Piperazinedione, 4-benzyl-1-(3-chloro-4-methylphenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6-Piperazinedione, 4-benzyl-1-(3-chloro-4-methylphenyl)- has 0 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 2,6-Piperazinedione, 4-benzyl-1-(3-chloro-4-methylphenyl)-?
The CAS number of 2,6-Piperazinedione, 4-benzyl-1-(3-chloro-4-methylphenyl)- is 13480-13-2.
What is the molecular formula of 2,6-Piperazinedione, 4-benzyl-1-(3-chloro-4-methylphenyl)-?
The molecular formula of 2,6-Piperazinedione, 4-benzyl-1-(3-chloro-4-methylphenyl)- is C18H17ClN2O2.
What is the molecular weight of 2,6-Piperazinedione, 4-benzyl-1-(3-chloro-4-methylphenyl)-?
The molecular weight of 2,6-Piperazinedione, 4-benzyl-1-(3-chloro-4-methylphenyl)- is 328.10 g/mol.
Where can I buy 2,6-Piperazinedione, 4-benzyl-1-(3-chloro-4-methylphenyl)-?
You can request a quote for 2,6-Piperazinedione, 4-benzyl-1-(3-chloro-4-methylphenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6-Piperazinedione, 4-benzyl-1-(3-chloro-4-methylphenyl)-?
Yes, KEHONG BIO provides custom synthesis services for 2,6-Piperazinedione, 4-benzyl-1-(3-chloro-4-methylphenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.