![2-(4-Methylphenoxy)-1-[4-(4-nitrobenzoyl)piperazin-1-yl]ethanone structure](/static/products/5226/522650-54-0.webp)
2-(4-Methylphenoxy)-1-[4-(4-nitrobenzoyl)piperazin-1-yl]ethanone
TL;DR: 2-(4-Methylphenoxy)-1-[4-(4-nitrobenzoyl)piperazin-1-yl]ethanone (CAS 522650-54-0) is a chemical compound with molecular formula C20H21N3O5 and molecular weight 383.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-methylphenoxy)-1-[4-(4-nitrobenzoyl)piperazin-1-yl]ethanone
Also Known As: BAS 04443387, 2-(4-methylphenoxy)-1-[4-(4-nitrobenzoyl)piperazin-1-yl]ethanone, 1-[4-(4-Nitro-benzoyl)-piperazin-1-yl]-2-p-tolyloxy-ethanone, 2-(4-METHYLPHENOXY)-1-[4-(4-NITROBENZOYL)PIPERAZINO]-1-ETHANONE, 2-(4-methylphenoxy)-1-{4-[(4-nitrophenyl)carbonyl]piperazin-1-yl}ethanone
| Molecular Formula | C20H21N3O5 |
|---|---|
| Molecular Weight | 383.15 g/mol |
| LogP | 2.26662 |
| Topological Polar Surface Area | 92.99 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 383.14813 |
| Heavy Atoms | 28 |
| Complexity | 856.41486 |
Chemical Identifiers
| CAS Number | 522650-54-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)OCC(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)[N+](=O)[O-] |
Product Overview
2-(4-Methylphenoxy)-1-[4-(4-nitrobenzoyl)piperazin-1-yl]ethanone (CAS 522650-54-0), with molecular formula C20H21N3O5 and molecular weight 383.15 g/mol. IUPAC: 2-(4-methylphenoxy)-1-[4-(4-nitrobenzoyl)piperazin-1-yl]ethanone.
Chemical Property Profile of 2-(4-Methylphenoxy)-1-[4-(4-nitrobenzoyl)piperazin-1-yl]ethanone
Property Insights of 2-(4-Methylphenoxy)-1-[4-(4-nitrobenzoyl)piperazin-1-yl]ethanone
The XLogP value of 2.26662 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Methylphenoxy)-1-[4-(4-nitrobenzoyl)piperazin-1-yl]ethanone. The TPSA of 92.99 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-Methylphenoxy)-1-[4-(4-nitrobenzoyl)piperazin-1-yl]ethanone. Following Lipinski's Rule of Five, 2-(4-Methylphenoxy)-1-[4-(4-nitrobenzoyl)piperazin-1-yl]ethanone has 0 hydrogen bond donor(s) and 5 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-(4-Methylphenoxy)-1-[4-(4-nitrobenzoyl)piperazin-1-yl]ethanone?
The CAS number of 2-(4-Methylphenoxy)-1-[4-(4-nitrobenzoyl)piperazin-1-yl]ethanone is 522650-54-0.
What is the molecular formula of 2-(4-Methylphenoxy)-1-[4-(4-nitrobenzoyl)piperazin-1-yl]ethanone?
The molecular formula of 2-(4-Methylphenoxy)-1-[4-(4-nitrobenzoyl)piperazin-1-yl]ethanone is C20H21N3O5.
What is the molecular weight of 2-(4-Methylphenoxy)-1-[4-(4-nitrobenzoyl)piperazin-1-yl]ethanone?
The molecular weight of 2-(4-Methylphenoxy)-1-[4-(4-nitrobenzoyl)piperazin-1-yl]ethanone is 383.15 g/mol.
Where can I buy 2-(4-Methylphenoxy)-1-[4-(4-nitrobenzoyl)piperazin-1-yl]ethanone?
You can request a quote for 2-(4-Methylphenoxy)-1-[4-(4-nitrobenzoyl)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-(4-Methylphenoxy)-1-[4-(4-nitrobenzoyl)piperazin-1-yl]ethanone?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Methylphenoxy)-1-[4-(4-nitrobenzoyl)piperazin-1-yl]ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.