3-Benzylsulfanyl-6-(3,4-dimethoxyphenyl)pyridazine
TL;DR: 3-Benzylsulfanyl-6-(3,4-dimethoxyphenyl)pyridazine (CAS 872688-75-0) is a chemical compound with molecular formula C19H18N2O2S and molecular weight 338.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-benzylsulfanyl-6-(3,4-dimethoxyphenyl)pyridazine
Also Known As: 3-(benzylthio)-6-(3,4-dimethoxyphenyl)pyridazine, 3-benzylsulfanyl-6-(3,4-dimethoxyphenyl)pyridazine, 3-(benzylsulfanyl)-6-(3,4-dimethoxyphenyl)pyridazine, F1899-0318
| Molecular Formula | C19H18N2O2S |
|---|---|
| Molecular Weight | 338.11 g/mol |
| LogP | 4.4531 |
| Topological Polar Surface Area | 44.24 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 338.1089 |
| Heavy Atoms | 24 |
| Complexity | 792.222 |
Chemical Identifiers
| CAS Number | 872688-75-0 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2=NN=C(C=C2)SCC3=CC=CC=C3)OC |
Product Overview
3-Benzylsulfanyl-6-(3,4-dimethoxyphenyl)pyridazine (CAS 872688-75-0), with molecular formula C19H18N2O2S and molecular weight 338.11 g/mol. IUPAC: 3-benzylsulfanyl-6-(3,4-dimethoxyphenyl)pyridazine.
Chemical Property Profile of 3-Benzylsulfanyl-6-(3,4-dimethoxyphenyl)pyridazine
Property Insights of 3-Benzylsulfanyl-6-(3,4-dimethoxyphenyl)pyridazine
The XLogP value of 4.4531 indicates that 3-Benzylsulfanyl-6-(3,4-dimethoxyphenyl)pyridazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.24 Ų, 3-Benzylsulfanyl-6-(3,4-dimethoxyphenyl)pyridazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Benzylsulfanyl-6-(3,4-dimethoxyphenyl)pyridazine has 0 hydrogen bond donor(s) and 5 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 3-Benzylsulfanyl-6-(3,4-dimethoxyphenyl)pyridazine?
The CAS number of 3-Benzylsulfanyl-6-(3,4-dimethoxyphenyl)pyridazine is 872688-75-0.
What is the molecular formula of 3-Benzylsulfanyl-6-(3,4-dimethoxyphenyl)pyridazine?
The molecular formula of 3-Benzylsulfanyl-6-(3,4-dimethoxyphenyl)pyridazine is C19H18N2O2S.
What is the molecular weight of 3-Benzylsulfanyl-6-(3,4-dimethoxyphenyl)pyridazine?
The molecular weight of 3-Benzylsulfanyl-6-(3,4-dimethoxyphenyl)pyridazine is 338.11 g/mol.
Where can I buy 3-Benzylsulfanyl-6-(3,4-dimethoxyphenyl)pyridazine?
You can request a quote for 3-Benzylsulfanyl-6-(3,4-dimethoxyphenyl)pyridazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Benzylsulfanyl-6-(3,4-dimethoxyphenyl)pyridazine?
Yes, KEHONG BIO provides custom synthesis services for 3-Benzylsulfanyl-6-(3,4-dimethoxyphenyl)pyridazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.