![[4-[3-(benzylamino)-4-nitrophenyl]piperazin-1-yl]-(2-methoxy-3-methylphenyl)methanone structure](/static/products/5975/597545-66-9.webp)
[4-[3-(benzylamino)-4-nitrophenyl]piperazin-1-yl]-(2-methoxy-3-methylphenyl)methanone
TL;DR: [4-[3-(benzylamino)-4-nitrophenyl]piperazin-1-yl]-(2-methoxy-3-methylphenyl)methanone (CAS 597545-66-9) is a chemical compound with molecular formula C26H28N4O4 and molecular weight 460.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[3-(benzylamino)-4-nitrophenyl]piperazin-1-yl]-(2-methoxy-3-methylphenyl)methanone
Also Known As: [4-[3-(benzylamino)-4-nitrophenyl]piperazin-1-yl]-(2-methoxy-3-methylphenyl)methanone|(4-(3-(benzylamino)-4-nitrophenyl)piperazin-1-yl)(2-methoxy-3-methylphenyl)methanone|[4-[3-(benzylamino)-4-nitro-phenyl]piperazin-1-yl]-(2-methoxy-3-methyl-phenyl)methanone|{4-[3-(benzylamino)-4-nitrophenyl]piperazin-1-yl}(2-methoxy-3-methylphenyl)methanone
| Molecular Formula | C26H28N4O4 |
|---|---|
| Molecular Weight | 460.21 g/mol |
| LogP | 4.48632 |
| Topological Polar Surface Area | 87.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 460.21106 |
| Heavy Atoms | 34 |
| Complexity | 1174.6731 |
Chemical Identifiers
| CAS Number | 597545-66-9 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)C(=O)N2CCN(CC2)C3=CC(=C(C=C3)[N+](=O)[O-])NCC4=CC=CC=C4)OC |
Product Overview
[4-[3-(benzylamino)-4-nitrophenyl]piperazin-1-yl]-(2-methoxy-3-methylphenyl)methanone (CAS 597545-66-9), with molecular formula C26H28N4O4 and molecular weight 460.21 g/mol. IUPAC: [4-[3-(benzylamino)-4-nitrophenyl]piperazin-1-yl]-(2-methoxy-3-methylphenyl)methanone.
Chemical Property Profile of [4-[3-(benzylamino)-4-nitrophenyl]piperazin-1-yl]-(2-methoxy-3-methylphenyl)methanone
Property Insights of [4-[3-(benzylamino)-4-nitrophenyl]piperazin-1-yl]-(2-methoxy-3-methylphenyl)methanone
The XLogP value of 4.48632 indicates that [4-[3-(benzylamino)-4-nitrophenyl]piperazin-1-yl]-(2-methoxy-3-methylphenyl)methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.95 Ų falls within the moderate polarity range, balancing permeability and solubility for [4-[3-(benzylamino)-4-nitrophenyl]piperazin-1-yl]-(2-methoxy-3-methylphenyl)methanone. Following Lipinski's Rule of Five, [4-[3-(benzylamino)-4-nitrophenyl]piperazin-1-yl]-(2-methoxy-3-methylphenyl)methanone has 1 hydrogen bond donor(s) and 6 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-[3-(benzylamino)-4-nitrophenyl]piperazin-1-yl]-(2-methoxy-3-methylphenyl)methanone?
The CAS number of [4-[3-(benzylamino)-4-nitrophenyl]piperazin-1-yl]-(2-methoxy-3-methylphenyl)methanone is 597545-66-9.
What is the molecular formula of [4-[3-(benzylamino)-4-nitrophenyl]piperazin-1-yl]-(2-methoxy-3-methylphenyl)methanone?
The molecular formula of [4-[3-(benzylamino)-4-nitrophenyl]piperazin-1-yl]-(2-methoxy-3-methylphenyl)methanone is C26H28N4O4.
What is the molecular weight of [4-[3-(benzylamino)-4-nitrophenyl]piperazin-1-yl]-(2-methoxy-3-methylphenyl)methanone?
The molecular weight of [4-[3-(benzylamino)-4-nitrophenyl]piperazin-1-yl]-(2-methoxy-3-methylphenyl)methanone is 460.21 g/mol.
Where can I buy [4-[3-(benzylamino)-4-nitrophenyl]piperazin-1-yl]-(2-methoxy-3-methylphenyl)methanone?
You can request a quote for [4-[3-(benzylamino)-4-nitrophenyl]piperazin-1-yl]-(2-methoxy-3-methylphenyl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [4-[3-(benzylamino)-4-nitrophenyl]piperazin-1-yl]-(2-methoxy-3-methylphenyl)methanone?
Yes, KEHONG BIO provides custom synthesis services for [4-[3-(benzylamino)-4-nitrophenyl]piperazin-1-yl]-(2-methoxy-3-methylphenyl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.