2-benzyl-5-(benzylsulfanyl)-4-(methylsulfanyl)-3(2H)-pyridazinone
TL;DR: 2-benzyl-5-(benzylsulfanyl)-4-(methylsulfanyl)-3(2H)-pyridazinone (CAS 724436-47-9) is a chemical compound with molecular formula C19H18N2OS2 and molecular weight 354.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzyl-5-benzylsulfanyl-4-methylsulfanylpyridazin-3-one
Also Known As: 2-benzyl-5-(benzylsulfanyl)-4-(methylsulfanyl)-3(2H)-pyridazinone, 2-benzyl-5-benzylsulfanyl-4-methylsulfanylpyridazin-3-one, AP-786/42299934, 2-benzyl-5-(benzylthio)-4-(methylthio)pyridazin-3-one, 4-(methylthio)-2-(phenylmethyl)-5-(phenylmethylthio)-3-pyridazinone
| Molecular Formula | C19H18N2OS2 |
|---|---|
| Molecular Weight | 354.09 g/mol |
| LogP | 4.3058 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 354.08606 |
| Heavy Atoms | 24 |
| Complexity | 848.24567 |
Chemical Identifiers
| CAS Number | 724436-47-9 |
|---|---|
| SMILES | CSC1=C(C=NN(C1=O)CC2=CC=CC=C2)SCC3=CC=CC=C3 |
Product Overview
2-benzyl-5-(benzylsulfanyl)-4-(methylsulfanyl)-3(2H)-pyridazinone (CAS 724436-47-9), with molecular formula C19H18N2OS2 and molecular weight 354.09 g/mol. IUPAC: 2-benzyl-5-benzylsulfanyl-4-methylsulfanylpyridazin-3-one.
Chemical Property Profile of 2-benzyl-5-(benzylsulfanyl)-4-(methylsulfanyl)-3(2H)-pyridazinone
Property Insights of 2-benzyl-5-(benzylsulfanyl)-4-(methylsulfanyl)-3(2H)-pyridazinone
The XLogP value of 4.3058 indicates that 2-benzyl-5-(benzylsulfanyl)-4-(methylsulfanyl)-3(2H)-pyridazinone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.89 Ų, 2-benzyl-5-(benzylsulfanyl)-4-(methylsulfanyl)-3(2H)-pyridazinone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-benzyl-5-(benzylsulfanyl)-4-(methylsulfanyl)-3(2H)-pyridazinone has 0 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 2-benzyl-5-(benzylsulfanyl)-4-(methylsulfanyl)-3(2H)-pyridazinone?
The CAS number of 2-benzyl-5-(benzylsulfanyl)-4-(methylsulfanyl)-3(2H)-pyridazinone is 724436-47-9.
What is the molecular formula of 2-benzyl-5-(benzylsulfanyl)-4-(methylsulfanyl)-3(2H)-pyridazinone?
The molecular formula of 2-benzyl-5-(benzylsulfanyl)-4-(methylsulfanyl)-3(2H)-pyridazinone is C19H18N2OS2.
What is the molecular weight of 2-benzyl-5-(benzylsulfanyl)-4-(methylsulfanyl)-3(2H)-pyridazinone?
The molecular weight of 2-benzyl-5-(benzylsulfanyl)-4-(methylsulfanyl)-3(2H)-pyridazinone is 354.09 g/mol.
Where can I buy 2-benzyl-5-(benzylsulfanyl)-4-(methylsulfanyl)-3(2H)-pyridazinone?
You can request a quote for 2-benzyl-5-(benzylsulfanyl)-4-(methylsulfanyl)-3(2H)-pyridazinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-benzyl-5-(benzylsulfanyl)-4-(methylsulfanyl)-3(2H)-pyridazinone?
Yes, KEHONG BIO provides custom synthesis services for 2-benzyl-5-(benzylsulfanyl)-4-(methylsulfanyl)-3(2H)-pyridazinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.