![2-(1-Adamantyl)-1-[4-(2-chloro-6-nitrophenyl)piperazin-1-yl]ethanone structure](/static/products/7012/701283-41-2.webp)
2-(1-Adamantyl)-1-[4-(2-chloro-6-nitrophenyl)piperazin-1-yl]ethanone
TL;DR: 2-(1-Adamantyl)-1-[4-(2-chloro-6-nitrophenyl)piperazin-1-yl]ethanone (CAS 701283-41-2) is a chemical compound with molecular formula C22H28ClN3O3 and molecular weight 417.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1-adamantyl)-1-[4-(2-chloro-6-nitrophenyl)piperazin-1-yl]ethanone
Also Known As: 2-(1-adamantyl)-1-[4-(2-chloro-6-nitrophenyl)piperazin-1-yl]ethanone, 1-[4-(2-chloro-6-nitrophenyl)piperazin-1-yl]-2-(tricyclo[3.3.1.1~3,7~]dec-1-yl)ethanone
| Molecular Formula | C22H28ClN3O3 |
|---|---|
| Molecular Weight | 417.18 g/mol |
| LogP | 4.5033 |
| Topological Polar Surface Area | 66.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 417.18192 |
| Heavy Atoms | 29 |
| Complexity | 799.30725 |
Chemical Identifiers
| CAS Number | 701283-41-2 |
|---|---|
| SMILES | C1CN(CCN1C2=C(C=CC=C2Cl)[N+](=O)[O-])C(=O)CC34CC5CC(C3)CC(C5)C4 |
Product Overview
2-(1-Adamantyl)-1-[4-(2-chloro-6-nitrophenyl)piperazin-1-yl]ethanone (CAS 701283-41-2), with molecular formula C22H28ClN3O3 and molecular weight 417.18 g/mol. IUPAC: 2-(1-adamantyl)-1-[4-(2-chloro-6-nitrophenyl)piperazin-1-yl]ethanone.
Chemical Property Profile of 2-(1-Adamantyl)-1-[4-(2-chloro-6-nitrophenyl)piperazin-1-yl]ethanone
Property Insights of 2-(1-Adamantyl)-1-[4-(2-chloro-6-nitrophenyl)piperazin-1-yl]ethanone
The XLogP value of 4.5033 indicates that 2-(1-Adamantyl)-1-[4-(2-chloro-6-nitrophenyl)piperazin-1-yl]ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.69 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(1-Adamantyl)-1-[4-(2-chloro-6-nitrophenyl)piperazin-1-yl]ethanone. Following Lipinski's Rule of Five, 2-(1-Adamantyl)-1-[4-(2-chloro-6-nitrophenyl)piperazin-1-yl]ethanone 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 2-(1-Adamantyl)-1-[4-(2-chloro-6-nitrophenyl)piperazin-1-yl]ethanone?
The CAS number of 2-(1-Adamantyl)-1-[4-(2-chloro-6-nitrophenyl)piperazin-1-yl]ethanone is 701283-41-2.
What is the molecular formula of 2-(1-Adamantyl)-1-[4-(2-chloro-6-nitrophenyl)piperazin-1-yl]ethanone?
The molecular formula of 2-(1-Adamantyl)-1-[4-(2-chloro-6-nitrophenyl)piperazin-1-yl]ethanone is C22H28ClN3O3.
What is the molecular weight of 2-(1-Adamantyl)-1-[4-(2-chloro-6-nitrophenyl)piperazin-1-yl]ethanone?
The molecular weight of 2-(1-Adamantyl)-1-[4-(2-chloro-6-nitrophenyl)piperazin-1-yl]ethanone is 417.18 g/mol.
Where can I buy 2-(1-Adamantyl)-1-[4-(2-chloro-6-nitrophenyl)piperazin-1-yl]ethanone?
You can request a quote for 2-(1-Adamantyl)-1-[4-(2-chloro-6-nitrophenyl)piperazin-1-yl]ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1-Adamantyl)-1-[4-(2-chloro-6-nitrophenyl)piperazin-1-yl]ethanone?
Yes, KEHONG BIO provides custom synthesis services for 2-(1-Adamantyl)-1-[4-(2-chloro-6-nitrophenyl)piperazin-1-yl]ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.