2,3-Piperazinedione, 1-(3-chloro-4-(diethylamino)benzyl)-4-hexyl-
TL;DR: 2,3-Piperazinedione, 1-(3-chloro-4-(diethylamino)benzyl)-4-hexyl- (CAS 77918-01-5) is a chemical compound with molecular formula C21H32ClN3O2 and molecular weight 393.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[[3-chloro-4-(diethylamino)phenyl]methyl]-4-hexylpiperazine-2,3-dione
Also Known As: 1-(3-Chloro-4-(diethylamino)benzyl)-4-hexyl-2,3-piperazinedione, 2,3-Piperazinedione, 1-(3-chloro-4-(diethylamino)benzyl)-4-hexyl-, 1-(3-chloro-4-4-hexyl-2,3-piperazinedione, 1-(3-Chloro-4-diethylamino)benzyl-4-n-hexyl-2,3-dioxopiperazine, 1-(3-Chloro-4- -4-hexyl-2,3-piperazinedione
| Molecular Formula | C21H32ClN3O2 |
|---|---|
| Molecular Weight | 393.22 g/mol |
| LogP | 3.9373 |
| Topological Polar Surface Area | 43.86 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 10 |
| Exact Mass | 393.2183 |
| Heavy Atoms | 27 |
| Complexity | 646.3139 |
Chemical Identifiers
| CAS Number | 77918-01-5 |
|---|---|
| SMILES | CCCCCCN1CCN(C(=O)C1=O)CC2=CC(=C(C=C2)N(CC)CC)Cl |
Product Overview
2,3-Piperazinedione, 1-(3-chloro-4-(diethylamino)benzyl)-4-hexyl- (CAS 77918-01-5), with molecular formula C21H32ClN3O2 and molecular weight 393.22 g/mol. IUPAC: 1-[[3-chloro-4-(diethylamino)phenyl]methyl]-4-hexylpiperazine-2,3-dione.
Chemical Property Profile of 2,3-Piperazinedione, 1-(3-chloro-4-(diethylamino)benzyl)-4-hexyl-
Property Insights of 2,3-Piperazinedione, 1-(3-chloro-4-(diethylamino)benzyl)-4-hexyl-
The XLogP value of 3.9373 indicates that 2,3-Piperazinedione, 1-(3-chloro-4-(diethylamino)benzyl)-4-hexyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.86 Ų, 2,3-Piperazinedione, 1-(3-chloro-4-(diethylamino)benzyl)-4-hexyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3-Piperazinedione, 1-(3-chloro-4-(diethylamino)benzyl)-4-hexyl- 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 2,3-Piperazinedione, 1-(3-chloro-4-(diethylamino)benzyl)-4-hexyl-?
The CAS number of 2,3-Piperazinedione, 1-(3-chloro-4-(diethylamino)benzyl)-4-hexyl- is 77918-01-5.
What is the molecular formula of 2,3-Piperazinedione, 1-(3-chloro-4-(diethylamino)benzyl)-4-hexyl-?
The molecular formula of 2,3-Piperazinedione, 1-(3-chloro-4-(diethylamino)benzyl)-4-hexyl- is C21H32ClN3O2.
What is the molecular weight of 2,3-Piperazinedione, 1-(3-chloro-4-(diethylamino)benzyl)-4-hexyl-?
The molecular weight of 2,3-Piperazinedione, 1-(3-chloro-4-(diethylamino)benzyl)-4-hexyl- is 393.22 g/mol.
Where can I buy 2,3-Piperazinedione, 1-(3-chloro-4-(diethylamino)benzyl)-4-hexyl-?
You can request a quote for 2,3-Piperazinedione, 1-(3-chloro-4-(diethylamino)benzyl)-4-hexyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3-Piperazinedione, 1-(3-chloro-4-(diethylamino)benzyl)-4-hexyl-?
Yes, KEHONG BIO provides custom synthesis services for 2,3-Piperazinedione, 1-(3-chloro-4-(diethylamino)benzyl)-4-hexyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.