N-(2-methylsulfanylphenyl)-2-[4-(2-phenylethenylsulfonyl)piperazin-1-yl]acetamide
TL;DR: N-(2-methylsulfanylphenyl)-2-[4-(2-phenylethenylsulfonyl)piperazin-1-yl]acetamide (CAS 790250-92-9) is a chemical compound with molecular formula C21H25N3O3S2 and molecular weight 431.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-methylsulfanylphenyl)-2-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]acetamide
Also Known As: N-(2-methylsulfanylphenyl)-2-[4-(2-phenylethenylsulfonyl)piperazin-1-yl]acetamide, N-(2-methylsulfanylphenyl)-2-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]acetamide, N-[2-(methylsulfanyl)phenyl]-2-[4-(2-phenylethenesulfonyl)piperazin-1-yl]acetamide
| Molecular Formula | C21H25N3O3S2 |
|---|---|
| Molecular Weight | 431.13 g/mol |
| LogP | 2.9653 |
| Topological Polar Surface Area | 69.72 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 431.13373 |
| Heavy Atoms | 29 |
| Complexity | 954.1464 |
Chemical Identifiers
| CAS Number | 790250-92-9 |
|---|---|
| SMILES | CSC1=CC=CC=C1NC(=O)CN2CCN(CC2)S(=O)(=O)/C=C/C3=CC=CC=C3 |
Product Overview
N-(2-methylsulfanylphenyl)-2-[4-(2-phenylethenylsulfonyl)piperazin-1-yl]acetamide (CAS 790250-92-9), with molecular formula C21H25N3O3S2 and molecular weight 431.13 g/mol. IUPAC: N-(2-methylsulfanylphenyl)-2-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]acetamide.
Chemical Property Profile of N-(2-methylsulfanylphenyl)-2-[4-(2-phenylethenylsulfonyl)piperazin-1-yl]acetamide
Property Insights of N-(2-methylsulfanylphenyl)-2-[4-(2-phenylethenylsulfonyl)piperazin-1-yl]acetamide
The XLogP value of 2.9653 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-methylsulfanylphenyl)-2-[4-(2-phenylethenylsulfonyl)piperazin-1-yl]acetamide. The TPSA of 69.72 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-methylsulfanylphenyl)-2-[4-(2-phenylethenylsulfonyl)piperazin-1-yl]acetamide. Following Lipinski's Rule of Five, N-(2-methylsulfanylphenyl)-2-[4-(2-phenylethenylsulfonyl)piperazin-1-yl]acetamide has 1 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 N-(2-methylsulfanylphenyl)-2-[4-(2-phenylethenylsulfonyl)piperazin-1-yl]acetamide?
The CAS number of N-(2-methylsulfanylphenyl)-2-[4-(2-phenylethenylsulfonyl)piperazin-1-yl]acetamide is 790250-92-9.
What is the molecular formula of N-(2-methylsulfanylphenyl)-2-[4-(2-phenylethenylsulfonyl)piperazin-1-yl]acetamide?
The molecular formula of N-(2-methylsulfanylphenyl)-2-[4-(2-phenylethenylsulfonyl)piperazin-1-yl]acetamide is C21H25N3O3S2.
What is the molecular weight of N-(2-methylsulfanylphenyl)-2-[4-(2-phenylethenylsulfonyl)piperazin-1-yl]acetamide?
The molecular weight of N-(2-methylsulfanylphenyl)-2-[4-(2-phenylethenylsulfonyl)piperazin-1-yl]acetamide is 431.13 g/mol.
Where can I buy N-(2-methylsulfanylphenyl)-2-[4-(2-phenylethenylsulfonyl)piperazin-1-yl]acetamide?
You can request a quote for N-(2-methylsulfanylphenyl)-2-[4-(2-phenylethenylsulfonyl)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-methylsulfanylphenyl)-2-[4-(2-phenylethenylsulfonyl)piperazin-1-yl]acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2-methylsulfanylphenyl)-2-[4-(2-phenylethenylsulfonyl)piperazin-1-yl]acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.