![1-(Azepan-1-yl)-2-[6-(4-ethylphenyl)pyridazin-3-yl]sulfanylethanone structure](/static/products/896/896045-91-3.png)
1-(Azepan-1-yl)-2-[6-(4-ethylphenyl)pyridazin-3-yl]sulfanylethanone
TL;DR: 1-(Azepan-1-yl)-2-[6-(4-ethylphenyl)pyridazin-3-yl]sulfanylethanone (CAS 896045-91-3) is a chemical compound with molecular formula C20H25N3OS and molecular weight 355.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(azepan-1-yl)-2-[6-(4-ethylphenyl)pyridazin-3-yl]sulfanylethanone
Also Known As: F1899-1004, 1-(azepan-1-yl)-2-((6-(4-ethylphenyl)pyridazin-3-yl)thio)ethanone, 1-(azepan-1-yl)-2-[6-(4-ethylphenyl)pyridazin-3-yl]sulfanylethanone, 2-[[6-(4-Ethylphenyl)-3-pyridazinyl]thio]-1-(hexahydro-1H-azepin-1-yl)ethanone, 1-(azepan-1-yl)-2-{[6-(4-ethylphenyl)pyridazin-3-yl]sulfanyl}ethan-1-one
| Molecular Formula | C20H25N3OS |
|---|---|
| Molecular Weight | 355.17 g/mol |
| LogP | 4.2007 |
| Topological Polar Surface Area | 46.09 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 355.17184 |
| Heavy Atoms | 25 |
| Complexity | 677.0924 |
Chemical Identifiers
| CAS Number | 896045-91-3 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)C2=NN=C(C=C2)SCC(=O)N3CCCCCC3 |
Product Overview
1-(Azepan-1-yl)-2-[6-(4-ethylphenyl)pyridazin-3-yl]sulfanylethanone (CAS 896045-91-3), with molecular formula C20H25N3OS and molecular weight 355.17 g/mol. IUPAC: 1-(azepan-1-yl)-2-[6-(4-ethylphenyl)pyridazin-3-yl]sulfanylethanone.
Chemical Property Profile of 1-(Azepan-1-yl)-2-[6-(4-ethylphenyl)pyridazin-3-yl]sulfanylethanone
Property Insights of 1-(Azepan-1-yl)-2-[6-(4-ethylphenyl)pyridazin-3-yl]sulfanylethanone
The XLogP value of 4.2007 indicates that 1-(Azepan-1-yl)-2-[6-(4-ethylphenyl)pyridazin-3-yl]sulfanylethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.09 Ų, 1-(Azepan-1-yl)-2-[6-(4-ethylphenyl)pyridazin-3-yl]sulfanylethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Azepan-1-yl)-2-[6-(4-ethylphenyl)pyridazin-3-yl]sulfanylethanone 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 1-(Azepan-1-yl)-2-[6-(4-ethylphenyl)pyridazin-3-yl]sulfanylethanone?
The CAS number of 1-(Azepan-1-yl)-2-[6-(4-ethylphenyl)pyridazin-3-yl]sulfanylethanone is 896045-91-3.
What is the molecular formula of 1-(Azepan-1-yl)-2-[6-(4-ethylphenyl)pyridazin-3-yl]sulfanylethanone?
The molecular formula of 1-(Azepan-1-yl)-2-[6-(4-ethylphenyl)pyridazin-3-yl]sulfanylethanone is C20H25N3OS.
What is the molecular weight of 1-(Azepan-1-yl)-2-[6-(4-ethylphenyl)pyridazin-3-yl]sulfanylethanone?
The molecular weight of 1-(Azepan-1-yl)-2-[6-(4-ethylphenyl)pyridazin-3-yl]sulfanylethanone is 355.17 g/mol.
Where can I buy 1-(Azepan-1-yl)-2-[6-(4-ethylphenyl)pyridazin-3-yl]sulfanylethanone?
You can request a quote for 1-(Azepan-1-yl)-2-[6-(4-ethylphenyl)pyridazin-3-yl]sulfanylethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Azepan-1-yl)-2-[6-(4-ethylphenyl)pyridazin-3-yl]sulfanylethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(Azepan-1-yl)-2-[6-(4-ethylphenyl)pyridazin-3-yl]sulfanylethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.