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N-[4-(4-acetylpiperazin-1-yl)phenyl]-4-methoxy-3-nitrobenzamide
TL;DR: N-[4-(4-acetylpiperazin-1-yl)phenyl]-4-methoxy-3-nitrobenzamide (CAS 335420-85-4) is a chemical compound with molecular formula C20H22N4O5 and molecular weight 398.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-(4-acetylpiperazin-1-yl)phenyl]-4-methoxy-3-nitrobenzamide
Also Known As: BAS 02244531, N-[4-(4-acetylpiperazin-1-yl)phenyl]-4-methoxy-3-nitrobenzamide, N-[4-(4-acetylpiperazin-1-yl)phenyl]-3-nitro-4-methoxybenzamide, N-[4-(4-Acetyl-piperazin-1-yl)-phenyl]-4-methoxy-3-nitro-benzamide
| Molecular Formula | C20H22N4O5 |
|---|---|
| Molecular Weight | 398.16 g/mol |
| LogP | 2.5242 |
| Topological Polar Surface Area | 105.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 398.15903 |
| Heavy Atoms | 29 |
| Complexity | 920.9689 |
Chemical Identifiers
| CAS Number | 335420-85-4 |
|---|---|
| SMILES | CC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=CC(=C(C=C3)OC)[N+](=O)[O-] |
Product Overview
N-[4-(4-acetylpiperazin-1-yl)phenyl]-4-methoxy-3-nitrobenzamide (CAS 335420-85-4), with molecular formula C20H22N4O5 and molecular weight 398.16 g/mol. IUPAC: N-[4-(4-acetylpiperazin-1-yl)phenyl]-4-methoxy-3-nitrobenzamide.
Chemical Property Profile of N-[4-(4-acetylpiperazin-1-yl)phenyl]-4-methoxy-3-nitrobenzamide
Property Insights of N-[4-(4-acetylpiperazin-1-yl)phenyl]-4-methoxy-3-nitrobenzamide
The XLogP value of 2.5242 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[4-(4-acetylpiperazin-1-yl)phenyl]-4-methoxy-3-nitrobenzamide. The TPSA of 105.02 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[4-(4-acetylpiperazin-1-yl)phenyl]-4-methoxy-3-nitrobenzamide. Following Lipinski's Rule of Five, N-[4-(4-acetylpiperazin-1-yl)phenyl]-4-methoxy-3-nitrobenzamide 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 N-[4-(4-acetylpiperazin-1-yl)phenyl]-4-methoxy-3-nitrobenzamide?
The CAS number of N-[4-(4-acetylpiperazin-1-yl)phenyl]-4-methoxy-3-nitrobenzamide is 335420-85-4.
What is the molecular formula of N-[4-(4-acetylpiperazin-1-yl)phenyl]-4-methoxy-3-nitrobenzamide?
The molecular formula of N-[4-(4-acetylpiperazin-1-yl)phenyl]-4-methoxy-3-nitrobenzamide is C20H22N4O5.
What is the molecular weight of N-[4-(4-acetylpiperazin-1-yl)phenyl]-4-methoxy-3-nitrobenzamide?
The molecular weight of N-[4-(4-acetylpiperazin-1-yl)phenyl]-4-methoxy-3-nitrobenzamide is 398.16 g/mol.
Where can I buy N-[4-(4-acetylpiperazin-1-yl)phenyl]-4-methoxy-3-nitrobenzamide?
You can request a quote for N-[4-(4-acetylpiperazin-1-yl)phenyl]-4-methoxy-3-nitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[4-(4-acetylpiperazin-1-yl)phenyl]-4-methoxy-3-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[4-(4-acetylpiperazin-1-yl)phenyl]-4-methoxy-3-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.