N-(4-methylbenzyl)-2-((6-phenylpyridazin-3-yl)thio)acetamide
TL;DR: N-(4-methylbenzyl)-2-((6-phenylpyridazin-3-yl)thio)acetamide (CAS 872688-46-5) is a chemical compound with molecular formula C20H19N3OS and molecular weight 349.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(4-methylphenyl)methyl]-2-(6-phenylpyridazin-3-yl)sulfanylacetamide
Also Known As: F1899-0097, N-(4-methylbenzyl)-2-((6-phenylpyridazin-3-yl)thio)acetamide, N-(p-tolyl)methyl(6-phenyl-3-pyridazinylthio)acetamide, N-[(4-methylphenyl)methyl]-2-(6-phenylpyridazin-3-yl)sulfanylacetamide, N-[(4-methylphenyl)methyl]-2-[(6-phenylpyridazin-3-yl)sulfanyl]acetamide
| Molecular Formula | C20H19N3OS |
|---|---|
| Molecular Weight | 349.12 g/mol |
| LogP | 3.86052 |
| Topological Polar Surface Area | 54.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 349.12488 |
| Heavy Atoms | 25 |
| Complexity | 817.8248 |
Chemical Identifiers
| CAS Number | 872688-46-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CNC(=O)CSC2=NN=C(C=C2)C3=CC=CC=C3 |
Product Overview
N-(4-methylbenzyl)-2-((6-phenylpyridazin-3-yl)thio)acetamide (CAS 872688-46-5), with molecular formula C20H19N3OS and molecular weight 349.12 g/mol. IUPAC: N-[(4-methylphenyl)methyl]-2-(6-phenylpyridazin-3-yl)sulfanylacetamide.
Chemical Property Profile of N-(4-methylbenzyl)-2-((6-phenylpyridazin-3-yl)thio)acetamide
Property Insights of N-(4-methylbenzyl)-2-((6-phenylpyridazin-3-yl)thio)acetamide
The XLogP value of 3.86052 indicates that N-(4-methylbenzyl)-2-((6-phenylpyridazin-3-yl)thio)acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.88 Ų, N-(4-methylbenzyl)-2-((6-phenylpyridazin-3-yl)thio)acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-methylbenzyl)-2-((6-phenylpyridazin-3-yl)thio)acetamide has 1 hydrogen bond donor(s) and 4 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-methylbenzyl)-2-((6-phenylpyridazin-3-yl)thio)acetamide?
The CAS number of N-(4-methylbenzyl)-2-((6-phenylpyridazin-3-yl)thio)acetamide is 872688-46-5.
What is the molecular formula of N-(4-methylbenzyl)-2-((6-phenylpyridazin-3-yl)thio)acetamide?
The molecular formula of N-(4-methylbenzyl)-2-((6-phenylpyridazin-3-yl)thio)acetamide is C20H19N3OS.
What is the molecular weight of N-(4-methylbenzyl)-2-((6-phenylpyridazin-3-yl)thio)acetamide?
The molecular weight of N-(4-methylbenzyl)-2-((6-phenylpyridazin-3-yl)thio)acetamide is 349.12 g/mol.
Where can I buy N-(4-methylbenzyl)-2-((6-phenylpyridazin-3-yl)thio)acetamide?
You can request a quote for N-(4-methylbenzyl)-2-((6-phenylpyridazin-3-yl)thio)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-methylbenzyl)-2-((6-phenylpyridazin-3-yl)thio)acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-methylbenzyl)-2-((6-phenylpyridazin-3-yl)thio)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.