![4-(4-Chloro-2-methylphenoxy)-1-[4-(4-nitrophenyl)piperazin-1-yl]butan-1-one structure](/static/products/5407/540792-34-5.webp)
4-(4-Chloro-2-methylphenoxy)-1-[4-(4-nitrophenyl)piperazin-1-yl]butan-1-one
TL;DR: 4-(4-Chloro-2-methylphenoxy)-1-[4-(4-nitrophenyl)piperazin-1-yl]butan-1-one (CAS 540792-34-5) is a chemical compound with molecular formula C21H24ClN3O4 and molecular weight 417.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-chloro-2-methylphenoxy)-1-[4-(4-nitrophenyl)piperazin-1-yl]butan-1-one
Also Known As: 4-(4-chloro-2-methylphenoxy)-1-[4-(4-nitrophenyl)piperazin-1-yl]butan-1-one, 4-(4-chloro-2-methylphenoxy)-1-[4-(4-nitrophenyl)piperazinyl]butan-1-one, 4-(4-CHLORO-2-METHYLPHENOXY)-1-[4-(4-NITROPHENYL)PIPERAZINO]-1-BUTANONE
| Molecular Formula | C21H24ClN3O4 |
|---|---|
| Molecular Weight | 417.15 g/mol |
| LogP | 4.06442 |
| Topological Polar Surface Area | 75.92 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 417.14554 |
| Heavy Atoms | 29 |
| Complexity | 864.73 |
Chemical Identifiers
| CAS Number | 540792-34-5 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)Cl)OCCCC(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-] |
Product Overview
4-(4-Chloro-2-methylphenoxy)-1-[4-(4-nitrophenyl)piperazin-1-yl]butan-1-one (CAS 540792-34-5), with molecular formula C21H24ClN3O4 and molecular weight 417.15 g/mol. IUPAC: 4-(4-chloro-2-methylphenoxy)-1-[4-(4-nitrophenyl)piperazin-1-yl]butan-1-one.
Chemical Property Profile of 4-(4-Chloro-2-methylphenoxy)-1-[4-(4-nitrophenyl)piperazin-1-yl]butan-1-one
Property Insights of 4-(4-Chloro-2-methylphenoxy)-1-[4-(4-nitrophenyl)piperazin-1-yl]butan-1-one
The XLogP value of 4.06442 indicates that 4-(4-Chloro-2-methylphenoxy)-1-[4-(4-nitrophenyl)piperazin-1-yl]butan-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.92 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(4-Chloro-2-methylphenoxy)-1-[4-(4-nitrophenyl)piperazin-1-yl]butan-1-one. Following Lipinski's Rule of Five, 4-(4-Chloro-2-methylphenoxy)-1-[4-(4-nitrophenyl)piperazin-1-yl]butan-1-one 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 4-(4-Chloro-2-methylphenoxy)-1-[4-(4-nitrophenyl)piperazin-1-yl]butan-1-one?
The CAS number of 4-(4-Chloro-2-methylphenoxy)-1-[4-(4-nitrophenyl)piperazin-1-yl]butan-1-one is 540792-34-5.
What is the molecular formula of 4-(4-Chloro-2-methylphenoxy)-1-[4-(4-nitrophenyl)piperazin-1-yl]butan-1-one?
The molecular formula of 4-(4-Chloro-2-methylphenoxy)-1-[4-(4-nitrophenyl)piperazin-1-yl]butan-1-one is C21H24ClN3O4.
What is the molecular weight of 4-(4-Chloro-2-methylphenoxy)-1-[4-(4-nitrophenyl)piperazin-1-yl]butan-1-one?
The molecular weight of 4-(4-Chloro-2-methylphenoxy)-1-[4-(4-nitrophenyl)piperazin-1-yl]butan-1-one is 417.15 g/mol.
Where can I buy 4-(4-Chloro-2-methylphenoxy)-1-[4-(4-nitrophenyl)piperazin-1-yl]butan-1-one?
You can request a quote for 4-(4-Chloro-2-methylphenoxy)-1-[4-(4-nitrophenyl)piperazin-1-yl]butan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-Chloro-2-methylphenoxy)-1-[4-(4-nitrophenyl)piperazin-1-yl]butan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-Chloro-2-methylphenoxy)-1-[4-(4-nitrophenyl)piperazin-1-yl]butan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.