RefChem:371362
TL;DR: RefChem:371362 (CAS 53605-26-8) is a chemical compound with molecular formula C12H21N2O4PS and molecular weight 320.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethoxy-[6-(4-methylpentan-2-yloxy)pyridazin-3-yl]oxy-sulfanylidene-λ5-phosphane
Also Known As: O,O-Dimethyl O-(6-(1,3-dimethylbutoxy)-3-pyridazinyl) phosphorothioate, Phosphorothioic acid, O,O-dimethyl O-(6-(1,3-dimethylbutoxy)-3-pyridazinyl) ester, dimethoxy-[6-(4-methylpentan-2-yloxy)pyridazin-3-yl]oxy-sulfanylidene-, O,O-Dimethyl O-{6-[(4-methylpentan-2-yl)oxy]pyridazin-3-yl} phosphorothioate, BRN 0812658
| Molecular Formula | C12H21N2O4PS |
|---|---|
| Molecular Weight | 320.10 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 94.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 320.09598 |
| Heavy Atoms | 20 |
| Complexity | 325.0 |
Chemical Identifiers
| CAS Number | 53605-26-8 |
|---|---|
| SMILES | CC(C)CC(C)OC1=NN=C(C=C1)OP(=S)(OC)OC |
| InChIKey | BJJHHQUISVLXDZ-UHFFFAOYSA-N |
Product Overview
RefChem:371362 (CAS 53605-26-8), with molecular formula C12H21N2O4PS and molecular weight 320.10 g/mol. IUPAC: dimethoxy-[6-(4-methylpentan-2-yloxy)pyridazin-3-yl]oxy-sulfanylidene-λ5-phosphane.
Chemical Property Profile of RefChem:371362
Property Insights of RefChem:371362
The XLogP value of 3.7 indicates that RefChem:371362 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.8 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:371362. Following Lipinski's Rule of Five, RefChem:371362 has 0 hydrogen bond donor(s) and 7 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 RefChem:371362?
The CAS number of RefChem:371362 is 53605-26-8.
What is the molecular formula of RefChem:371362?
The molecular formula of RefChem:371362 is C12H21N2O4PS.
What is the molecular weight of RefChem:371362?
The molecular weight of RefChem:371362 is 320.10 g/mol.
Where can I buy RefChem:371362?
You can request a quote for RefChem:371362 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:371362?
Yes, KEHONG BIO provides custom synthesis services for RefChem:371362 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.