![4-[[2-[(2-Methylphenyl)methylsulfanyl]acetyl]amino]benzamide structure](/static/products/4284/428458-71-3.webp)
4-[[2-[(2-Methylphenyl)methylsulfanyl]acetyl]amino]benzamide
TL;DR: 4-[[2-[(2-Methylphenyl)methylsulfanyl]acetyl]amino]benzamide (CAS 428458-71-3) is a chemical compound with molecular formula C17H18N2O2S and molecular weight 314.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[2-[(2-methylphenyl)methylsulfanyl]acetyl]amino]benzamide
Also Known As: 4-({[(2-methylbenzyl)sulfanyl]acetyl}amino)benzamide, 4-[[2-[(2-methylphenyl)methylsulfanyl]acetyl]amino]benzamide, Cambridge id 6404060
| Molecular Formula | C17H18N2O2S |
|---|---|
| Molecular Weight | 314.11 g/mol |
| LogP | 2.96582 |
| Topological Polar Surface Area | 72.19 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 314.1089 |
| Heavy Atoms | 22 |
| Complexity | 668.6141 |
Chemical Identifiers
| CAS Number | 428458-71-3 |
|---|---|
| SMILES | CC1=CC=CC=C1CSCC(=O)NC2=CC=C(C=C2)C(=O)N |
Product Overview
4-[[2-[(2-Methylphenyl)methylsulfanyl]acetyl]amino]benzamide (CAS 428458-71-3), with molecular formula C17H18N2O2S and molecular weight 314.11 g/mol. IUPAC: 4-[[2-[(2-methylphenyl)methylsulfanyl]acetyl]amino]benzamide.
Chemical Property Profile of 4-[[2-[(2-Methylphenyl)methylsulfanyl]acetyl]amino]benzamide
Property Insights of 4-[[2-[(2-Methylphenyl)methylsulfanyl]acetyl]amino]benzamide
The XLogP value of 2.96582 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[[2-[(2-Methylphenyl)methylsulfanyl]acetyl]amino]benzamide. The TPSA of 72.19 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[[2-[(2-Methylphenyl)methylsulfanyl]acetyl]amino]benzamide. Following Lipinski's Rule of Five, 4-[[2-[(2-Methylphenyl)methylsulfanyl]acetyl]amino]benzamide has 2 hydrogen bond donor(s) and 3 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-[[2-[(2-Methylphenyl)methylsulfanyl]acetyl]amino]benzamide?
The CAS number of 4-[[2-[(2-Methylphenyl)methylsulfanyl]acetyl]amino]benzamide is 428458-71-3.
What is the molecular formula of 4-[[2-[(2-Methylphenyl)methylsulfanyl]acetyl]amino]benzamide?
The molecular formula of 4-[[2-[(2-Methylphenyl)methylsulfanyl]acetyl]amino]benzamide is C17H18N2O2S.
What is the molecular weight of 4-[[2-[(2-Methylphenyl)methylsulfanyl]acetyl]amino]benzamide?
The molecular weight of 4-[[2-[(2-Methylphenyl)methylsulfanyl]acetyl]amino]benzamide is 314.11 g/mol.
Where can I buy 4-[[2-[(2-Methylphenyl)methylsulfanyl]acetyl]amino]benzamide?
You can request a quote for 4-[[2-[(2-Methylphenyl)methylsulfanyl]acetyl]amino]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[[2-[(2-Methylphenyl)methylsulfanyl]acetyl]amino]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-[[2-[(2-Methylphenyl)methylsulfanyl]acetyl]amino]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.