2-((6-(4-Chlorophenyl)pyridazin-3-yl)thio)-1-(pyrrolidin-1-yl)ethanone
TL;DR: 2-((6-(4-Chlorophenyl)pyridazin-3-yl)thio)-1-(pyrrolidin-1-yl)ethanone (CAS 626222-85-3) is a chemical compound with molecular formula C16H16ClN3OS and molecular weight 333.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[6-(4-chlorophenyl)pyridazin-3-yl]sulfanyl-1-pyrrolidin-1-ylethanone
Also Known As: BAS 07276833, F1899-0161, 2-((6-(4-chlorophenyl)pyridazin-3-yl)thio)-1-(pyrrolidin-1-yl)ethanone, 2-[6-(4-Chloro-phenyl)-pyridazin-3-ylsulfanyl]-1-pyrrolidin-1-yl-ethanone, 2-[6-(4-chlorophenyl)pyridazin-3-yl]sulfanyl-1-pyrrolidin-1-ylethanone
| Molecular Formula | C16H16ClN3OS |
|---|---|
| Molecular Weight | 333.07 g/mol |
| LogP | 3.5115 |
| Topological Polar Surface Area | 46.09 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 333.07025 |
| Heavy Atoms | 22 |
| Complexity | 639.44543 |
Chemical Identifiers
| CAS Number | 626222-85-3 |
|---|---|
| SMILES | C1CCN(C1)C(=O)CSC2=NN=C(C=C2)C3=CC=C(C=C3)Cl |
Product Overview
2-((6-(4-Chlorophenyl)pyridazin-3-yl)thio)-1-(pyrrolidin-1-yl)ethanone (CAS 626222-85-3), with molecular formula C16H16ClN3OS and molecular weight 333.07 g/mol. IUPAC: 2-[6-(4-chlorophenyl)pyridazin-3-yl]sulfanyl-1-pyrrolidin-1-ylethanone.
Chemical Property Profile of 2-((6-(4-Chlorophenyl)pyridazin-3-yl)thio)-1-(pyrrolidin-1-yl)ethanone
Property Insights of 2-((6-(4-Chlorophenyl)pyridazin-3-yl)thio)-1-(pyrrolidin-1-yl)ethanone
The XLogP value of 3.5115 indicates that 2-((6-(4-Chlorophenyl)pyridazin-3-yl)thio)-1-(pyrrolidin-1-yl)ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.09 Ų, 2-((6-(4-Chlorophenyl)pyridazin-3-yl)thio)-1-(pyrrolidin-1-yl)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-((6-(4-Chlorophenyl)pyridazin-3-yl)thio)-1-(pyrrolidin-1-yl)ethanone 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-((6-(4-Chlorophenyl)pyridazin-3-yl)thio)-1-(pyrrolidin-1-yl)ethanone?
The CAS number of 2-((6-(4-Chlorophenyl)pyridazin-3-yl)thio)-1-(pyrrolidin-1-yl)ethanone is 626222-85-3.
What is the molecular formula of 2-((6-(4-Chlorophenyl)pyridazin-3-yl)thio)-1-(pyrrolidin-1-yl)ethanone?
The molecular formula of 2-((6-(4-Chlorophenyl)pyridazin-3-yl)thio)-1-(pyrrolidin-1-yl)ethanone is C16H16ClN3OS.
What is the molecular weight of 2-((6-(4-Chlorophenyl)pyridazin-3-yl)thio)-1-(pyrrolidin-1-yl)ethanone?
The molecular weight of 2-((6-(4-Chlorophenyl)pyridazin-3-yl)thio)-1-(pyrrolidin-1-yl)ethanone is 333.07 g/mol.
Where can I buy 2-((6-(4-Chlorophenyl)pyridazin-3-yl)thio)-1-(pyrrolidin-1-yl)ethanone?
You can request a quote for 2-((6-(4-Chlorophenyl)pyridazin-3-yl)thio)-1-(pyrrolidin-1-yl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((6-(4-Chlorophenyl)pyridazin-3-yl)thio)-1-(pyrrolidin-1-yl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 2-((6-(4-Chlorophenyl)pyridazin-3-yl)thio)-1-(pyrrolidin-1-yl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.