1-Benzyl-5-benzylsulfanyl-6-chloropyridazin-4-one
TL;DR: 1-Benzyl-5-benzylsulfanyl-6-chloropyridazin-4-one (CAS 724436-46-8) is a chemical compound with molecular formula C18H15ClN2OS and molecular weight 342.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-5-benzylsulfanyl-6-chloropyridazin-4-one
Also Known As: 1-benzyl-5-benzylsulfanyl-6-chloropyridazin-4-one, 1-benzyl-5-(benzylsulfanyl)-6-chloro-4(1H)-pyridazinone, AP-786/42299933
| Molecular Formula | C18H15ClN2OS |
|---|---|
| Molecular Weight | 342.06 g/mol |
| LogP | 4.2373 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 342.05936 |
| Heavy Atoms | 23 |
| Complexity | 834.6454 |
Chemical Identifiers
| CAS Number | 724436-46-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN2C(=C(C(=O)C=N2)SCC3=CC=CC=C3)Cl |
Product Overview
1-Benzyl-5-benzylsulfanyl-6-chloropyridazin-4-one (CAS 724436-46-8), with molecular formula C18H15ClN2OS and molecular weight 342.06 g/mol. IUPAC: 1-benzyl-5-benzylsulfanyl-6-chloropyridazin-4-one.
Chemical Property Profile of 1-Benzyl-5-benzylsulfanyl-6-chloropyridazin-4-one
Property Insights of 1-Benzyl-5-benzylsulfanyl-6-chloropyridazin-4-one
The XLogP value of 4.2373 indicates that 1-Benzyl-5-benzylsulfanyl-6-chloropyridazin-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.89 Ų, 1-Benzyl-5-benzylsulfanyl-6-chloropyridazin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Benzyl-5-benzylsulfanyl-6-chloropyridazin-4-one has 0 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 1-Benzyl-5-benzylsulfanyl-6-chloropyridazin-4-one?
The CAS number of 1-Benzyl-5-benzylsulfanyl-6-chloropyridazin-4-one is 724436-46-8.
What is the molecular formula of 1-Benzyl-5-benzylsulfanyl-6-chloropyridazin-4-one?
The molecular formula of 1-Benzyl-5-benzylsulfanyl-6-chloropyridazin-4-one is C18H15ClN2OS.
What is the molecular weight of 1-Benzyl-5-benzylsulfanyl-6-chloropyridazin-4-one?
The molecular weight of 1-Benzyl-5-benzylsulfanyl-6-chloropyridazin-4-one is 342.06 g/mol.
Where can I buy 1-Benzyl-5-benzylsulfanyl-6-chloropyridazin-4-one?
You can request a quote for 1-Benzyl-5-benzylsulfanyl-6-chloropyridazin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Benzyl-5-benzylsulfanyl-6-chloropyridazin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 1-Benzyl-5-benzylsulfanyl-6-chloropyridazin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.