![2-Phenyl-2-[6-(phenylsulfanyl)-3-pyridazinyl]acetonitrile structure](/static/products/209/209412-02-2.png)
2-Phenyl-2-[6-(phenylsulfanyl)-3-pyridazinyl]acetonitrile
TL;DR: 2-Phenyl-2-[6-(phenylsulfanyl)-3-pyridazinyl]acetonitrile (CAS 209412-02-2) is a chemical compound with molecular formula C18H13N3S and molecular weight 303.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-phenyl-2-(6-phenylsulfanylpyridazin-3-yl)acetonitrile
Also Known As: 2-phenyl-2-[6-(phenylsulfanyl)-3-pyridazinyl]acetonitrile, 2-phenyl-2-[6-(phenylsulfanyl)pyridazin-3-yl]acetonitrile, 2-phenyl-2-(6-phenylsulfanylpyridazin-3-yl)acetonitrile, J2.693.948H, 8F-001
| Molecular Formula | C18H13N3S |
|---|---|
| Molecular Weight | 303.08 g/mol |
| LogP | 4.28328 |
| Topological Polar Surface Area | 49.57 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 303.083 |
| Heavy Atoms | 22 |
| Complexity | 764.93744 |
Chemical Identifiers
| CAS Number | 209412-02-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(C#N)C2=NN=C(C=C2)SC3=CC=CC=C3 |
Product Overview
2-Phenyl-2-[6-(phenylsulfanyl)-3-pyridazinyl]acetonitrile (CAS 209412-02-2), with molecular formula C18H13N3S and molecular weight 303.08 g/mol. IUPAC: 2-phenyl-2-(6-phenylsulfanylpyridazin-3-yl)acetonitrile.
Chemical Property Profile of 2-Phenyl-2-[6-(phenylsulfanyl)-3-pyridazinyl]acetonitrile
Property Insights of 2-Phenyl-2-[6-(phenylsulfanyl)-3-pyridazinyl]acetonitrile
The XLogP value of 4.28328 indicates that 2-Phenyl-2-[6-(phenylsulfanyl)-3-pyridazinyl]acetonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.57 Ų, 2-Phenyl-2-[6-(phenylsulfanyl)-3-pyridazinyl]acetonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Phenyl-2-[6-(phenylsulfanyl)-3-pyridazinyl]acetonitrile 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-Phenyl-2-[6-(phenylsulfanyl)-3-pyridazinyl]acetonitrile?
The CAS number of 2-Phenyl-2-[6-(phenylsulfanyl)-3-pyridazinyl]acetonitrile is 209412-02-2.
What is the molecular formula of 2-Phenyl-2-[6-(phenylsulfanyl)-3-pyridazinyl]acetonitrile?
The molecular formula of 2-Phenyl-2-[6-(phenylsulfanyl)-3-pyridazinyl]acetonitrile is C18H13N3S.
What is the molecular weight of 2-Phenyl-2-[6-(phenylsulfanyl)-3-pyridazinyl]acetonitrile?
The molecular weight of 2-Phenyl-2-[6-(phenylsulfanyl)-3-pyridazinyl]acetonitrile is 303.08 g/mol.
Where can I buy 2-Phenyl-2-[6-(phenylsulfanyl)-3-pyridazinyl]acetonitrile?
You can request a quote for 2-Phenyl-2-[6-(phenylsulfanyl)-3-pyridazinyl]acetonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Phenyl-2-[6-(phenylsulfanyl)-3-pyridazinyl]acetonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-Phenyl-2-[6-(phenylsulfanyl)-3-pyridazinyl]acetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.