3-(Benzylsulfanyl)-6-ethoxypyridazine
TL;DR: 3-(Benzylsulfanyl)-6-ethoxypyridazine (CAS 56756-91-3) is a chemical compound with molecular formula C13H14N2OS and molecular weight 246.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-benzylsulfanyl-6-ethoxypyridazine
Also Known As: 3-(benzylsulfanyl)-6-ethoxypyridazine, 3-benzylsulfanyl-6-ethoxypyridazine, 3-(Benzylthio)-6-ethoxypyridazine, AM-944/40947637, Bicyclo[3.1.1]heptanethiol,2,6,6-trimethyl-,rhodium(3+) salt (3:1)
| Molecular Formula | C13H14N2OS |
|---|---|
| Molecular Weight | 246.08 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 60.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 246.08269 |
| Heavy Atoms | 17 |
| Complexity | 210.0 |
Chemical Identifiers
| CAS Number | 56756-91-3 |
|---|---|
| SMILES | CCOC1=NN=C(C=C1)SCC2=CC=CC=C2 |
| InChIKey | GGGLAIPTDHMBBU-UHFFFAOYSA-N |
Product Overview
3-(Benzylsulfanyl)-6-ethoxypyridazine (CAS 56756-91-3), with molecular formula C13H14N2OS and molecular weight 246.08 g/mol. IUPAC: 3-benzylsulfanyl-6-ethoxypyridazine.
Chemical Property Profile of 3-(Benzylsulfanyl)-6-ethoxypyridazine
Property Insights of 3-(Benzylsulfanyl)-6-ethoxypyridazine
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Benzylsulfanyl)-6-ethoxypyridazine. The TPSA of 60.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(Benzylsulfanyl)-6-ethoxypyridazine. Following Lipinski's Rule of Five, 3-(Benzylsulfanyl)-6-ethoxypyridazine 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 3-(Benzylsulfanyl)-6-ethoxypyridazine?
The CAS number of 3-(Benzylsulfanyl)-6-ethoxypyridazine is 56756-91-3.
What is the molecular formula of 3-(Benzylsulfanyl)-6-ethoxypyridazine?
The molecular formula of 3-(Benzylsulfanyl)-6-ethoxypyridazine is C13H14N2OS.
What is the molecular weight of 3-(Benzylsulfanyl)-6-ethoxypyridazine?
The molecular weight of 3-(Benzylsulfanyl)-6-ethoxypyridazine is 246.08 g/mol.
Where can I buy 3-(Benzylsulfanyl)-6-ethoxypyridazine?
You can request a quote for 3-(Benzylsulfanyl)-6-ethoxypyridazine 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-ethoxypyridazine?
Yes, KEHONG BIO provides custom synthesis services for 3-(Benzylsulfanyl)-6-ethoxypyridazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.