Pyridazin-3(2H)-one, 4-mercapto-5-methoxy-2-phenyl-
TL;DR: Pyridazin-3(2H)-one, 4-mercapto-5-methoxy-2-phenyl- (CAS 5554-28-9) is a chemical compound with molecular formula C11H10N2O2S and molecular weight 234.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methoxy-2-phenyl-4-sulfanylidene-1H-pyridazin-3-one
Also Known As: pyridazinone, 2-5, 5-methoxy-2-phenyl-4-sulfanylpyridazin-3(2h)-one, 6-(4-methylpiperazin-1-yl)pyridine-3-sulfonic acid, AE-641/00400035, Pyridazin-3(2H)-one, 4-mercapto-5-methoxy-2-phenyl-
| Molecular Formula | C11H10N2O2S |
|---|---|
| Molecular Weight | 234.05 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 73.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 234.0463 |
| Heavy Atoms | 16 |
| Complexity | 335.0 |
Chemical Identifiers
| CAS Number | 5554-28-9 |
|---|---|
| SMILES | COC1=CNN(C(=O)C1=S)C2=CC=CC=C2 |
| InChIKey | YDJRWBYUUHSVTB-UHFFFAOYSA-N |
Product Overview
Pyridazin-3(2H)-one, 4-mercapto-5-methoxy-2-phenyl- (CAS 5554-28-9), with molecular formula C11H10N2O2S and molecular weight 234.05 g/mol. IUPAC: 5-methoxy-2-phenyl-4-sulfanylidene-1H-pyridazin-3-one.
Chemical Property Profile of Pyridazin-3(2H)-one, 4-mercapto-5-methoxy-2-phenyl-
Property Insights of Pyridazin-3(2H)-one, 4-mercapto-5-methoxy-2-phenyl-
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyridazin-3(2H)-one, 4-mercapto-5-methoxy-2-phenyl-. The TPSA of 73.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Pyridazin-3(2H)-one, 4-mercapto-5-methoxy-2-phenyl-. Following Lipinski's Rule of Five, Pyridazin-3(2H)-one, 4-mercapto-5-methoxy-2-phenyl- has 1 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 Pyridazin-3(2H)-one, 4-mercapto-5-methoxy-2-phenyl-?
The CAS number of Pyridazin-3(2H)-one, 4-mercapto-5-methoxy-2-phenyl- is 5554-28-9.
What is the molecular formula of Pyridazin-3(2H)-one, 4-mercapto-5-methoxy-2-phenyl-?
The molecular formula of Pyridazin-3(2H)-one, 4-mercapto-5-methoxy-2-phenyl- is C11H10N2O2S.
What is the molecular weight of Pyridazin-3(2H)-one, 4-mercapto-5-methoxy-2-phenyl-?
The molecular weight of Pyridazin-3(2H)-one, 4-mercapto-5-methoxy-2-phenyl- is 234.05 g/mol.
Where can I buy Pyridazin-3(2H)-one, 4-mercapto-5-methoxy-2-phenyl-?
You can request a quote for Pyridazin-3(2H)-one, 4-mercapto-5-methoxy-2-phenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyridazin-3(2H)-one, 4-mercapto-5-methoxy-2-phenyl-?
Yes, KEHONG BIO provides custom synthesis services for Pyridazin-3(2H)-one, 4-mercapto-5-methoxy-2-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.