RefChem:371283
TL;DR: RefChem:371283 (CAS 53605-13-3) is a chemical compound with molecular formula C16H21N2O4PS and molecular weight 368.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[6-(2,3-dimethylphenoxy)pyridazin-3-yl]oxy-diethoxy-sulfanylidene-λ5-phosphane
Also Known As: Phosphorothioic acid, O,O-diethyl O-(6-(2,3-dimethylphenoxy)-3-pyridazinyl) ester, O,O-Diethyl O-(6-(2,3-dimethylphenoxy)-3-pyridazinyl) phosphorothioate, [6-(2,3-dimethylphenoxy)pyridazin-3-yl]oxy-diethoxy-sulfanylidene-, O-[6-(2,3-dimethylphenoxy)pyridazin-3-yl] O,O-diethyl phosphorothioate, BRN 0844317
| Molecular Formula | C16H21N2O4PS |
|---|---|
| Molecular Weight | 368.10 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 94.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 368.09598 |
| Heavy Atoms | 24 |
| Complexity | 419.0 |
Chemical Identifiers
| CAS Number | 53605-13-3 |
|---|---|
| SMILES | CCOP(=S)(OCC)OC1=NN=C(C=C1)OC2=CC=CC(=C2C)C |
| InChIKey | JWWWTNNUTMAMDD-UHFFFAOYSA-N |
Product Overview
RefChem:371283 (CAS 53605-13-3), with molecular formula C16H21N2O4PS and molecular weight 368.10 g/mol. IUPAC: [6-(2,3-dimethylphenoxy)pyridazin-3-yl]oxy-diethoxy-sulfanylidene-λ5-phosphane.
Chemical Property Profile of RefChem:371283
Property Insights of RefChem:371283
The XLogP value of 4.6 indicates that RefChem:371283 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:371283. Following Lipinski's Rule of Five, RefChem:371283 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:371283?
The CAS number of RefChem:371283 is 53605-13-3.
What is the molecular formula of RefChem:371283?
The molecular formula of RefChem:371283 is C16H21N2O4PS.
What is the molecular weight of RefChem:371283?
The molecular weight of RefChem:371283 is 368.10 g/mol.
Where can I buy RefChem:371283?
You can request a quote for RefChem:371283 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:371283?
Yes, KEHONG BIO provides custom synthesis services for RefChem:371283 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.