![N-(2-methyl-5-nitrophenyl)-2-[4-(2-phenylethenesulfonyl)piperazin-1-yl]acetamide structure](/static/products/796/796124-51-1.png)
N-(2-methyl-5-nitrophenyl)-2-[4-(2-phenylethenesulfonyl)piperazin-1-yl]acetamide
TL;DR: N-(2-methyl-5-nitrophenyl)-2-[4-(2-phenylethenesulfonyl)piperazin-1-yl]acetamide (CAS 796124-51-1) is a chemical compound with molecular formula C21H24N4O5S and molecular weight 444.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-methyl-5-nitrophenyl)-2-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]acetamide
Also Known As: N-(2-methyl-5-nitro-phenyl)-2-[4-(2-phenylethenylsulfonyl)piperazin-1-yl]acetamide, N-(2-methyl-5-nitrophenyl)-2-[4-(2-phenylethenesulfonyl)piperazin-1-yl]acetamide, N-(2-methyl-5-nitrophenyl)-2-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]acetamide
| Molecular Formula | C21H24N4O5S |
|---|---|
| Molecular Weight | 444.15 g/mol |
| LogP | 2.46002 |
| Topological Polar Surface Area | 112.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 444.14673 |
| Heavy Atoms | 31 |
| Complexity | 1078.2039 |
Chemical Identifiers
| CAS Number | 796124-51-1 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CN2CCN(CC2)S(=O)(=O)/C=C/C3=CC=CC=C3 |
Product Overview
N-(2-methyl-5-nitrophenyl)-2-[4-(2-phenylethenesulfonyl)piperazin-1-yl]acetamide (CAS 796124-51-1), with molecular formula C21H24N4O5S and molecular weight 444.15 g/mol. IUPAC: N-(2-methyl-5-nitrophenyl)-2-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]acetamide.
Chemical Property Profile of N-(2-methyl-5-nitrophenyl)-2-[4-(2-phenylethenesulfonyl)piperazin-1-yl]acetamide
Property Insights of N-(2-methyl-5-nitrophenyl)-2-[4-(2-phenylethenesulfonyl)piperazin-1-yl]acetamide
The XLogP value of 2.46002 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-methyl-5-nitrophenyl)-2-[4-(2-phenylethenesulfonyl)piperazin-1-yl]acetamide. The TPSA of 112.86 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-methyl-5-nitrophenyl)-2-[4-(2-phenylethenesulfonyl)piperazin-1-yl]acetamide. Following Lipinski's Rule of Five, N-(2-methyl-5-nitrophenyl)-2-[4-(2-phenylethenesulfonyl)piperazin-1-yl]acetamide 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-(2-methyl-5-nitrophenyl)-2-[4-(2-phenylethenesulfonyl)piperazin-1-yl]acetamide?
The CAS number of N-(2-methyl-5-nitrophenyl)-2-[4-(2-phenylethenesulfonyl)piperazin-1-yl]acetamide is 796124-51-1.
What is the molecular formula of N-(2-methyl-5-nitrophenyl)-2-[4-(2-phenylethenesulfonyl)piperazin-1-yl]acetamide?
The molecular formula of N-(2-methyl-5-nitrophenyl)-2-[4-(2-phenylethenesulfonyl)piperazin-1-yl]acetamide is C21H24N4O5S.
What is the molecular weight of N-(2-methyl-5-nitrophenyl)-2-[4-(2-phenylethenesulfonyl)piperazin-1-yl]acetamide?
The molecular weight of N-(2-methyl-5-nitrophenyl)-2-[4-(2-phenylethenesulfonyl)piperazin-1-yl]acetamide is 444.15 g/mol.
Where can I buy N-(2-methyl-5-nitrophenyl)-2-[4-(2-phenylethenesulfonyl)piperazin-1-yl]acetamide?
You can request a quote for N-(2-methyl-5-nitrophenyl)-2-[4-(2-phenylethenesulfonyl)piperazin-1-yl]acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-methyl-5-nitrophenyl)-2-[4-(2-phenylethenesulfonyl)piperazin-1-yl]acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2-methyl-5-nitrophenyl)-2-[4-(2-phenylethenesulfonyl)piperazin-1-yl]acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.