4-chloro-5-diethoxyphosphinothioyloxy-2-methylpyridazine-3-thione
TL;DR: 4-chloro-5-diethoxyphosphinothioyloxy-2-methylpyridazine-3-thione (CAS 72039-19-1) is a chemical compound with molecular formula C9H14ClN2O3PS2 and molecular weight 327.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-5-diethoxyphosphinothioyloxy-2-methylpyridazine-3-thione
Also Known As: 4-chloro-5-diethoxyphosphinothioyloxy-2-methylpyridazine-3-thione, O-(5-Chloro-1-methyl-6-sulfanylidene-1,6-dihydropyridazin-4-yl) O,O-diethyl phosphorothioate
| Molecular Formula | C9H14ClN2O3PS2 |
|---|---|
| Molecular Weight | 327.99 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 107.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 327.9872 |
| Heavy Atoms | 18 |
| Complexity | 432.0 |
Chemical Identifiers
| CAS Number | 72039-19-1 |
|---|---|
| SMILES | CCOP(=S)(OCC)OC1=C(C(=S)N(N=C1)C)Cl |
| InChIKey | CKDFGHBBSMCKDG-UHFFFAOYSA-N |
Product Overview
4-chloro-5-diethoxyphosphinothioyloxy-2-methylpyridazine-3-thione (CAS 72039-19-1), with molecular formula C9H14ClN2O3PS2 and molecular weight 327.99 g/mol. IUPAC: 4-chloro-5-diethoxyphosphinothioyloxy-2-methylpyridazine-3-thione.
Chemical Property Profile of 4-chloro-5-diethoxyphosphinothioyloxy-2-methylpyridazine-3-thione
Property Insights of 4-chloro-5-diethoxyphosphinothioyloxy-2-methylpyridazine-3-thione
The XLogP value of 3.0 indicates that 4-chloro-5-diethoxyphosphinothioyloxy-2-methylpyridazine-3-thione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 107.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-chloro-5-diethoxyphosphinothioyloxy-2-methylpyridazine-3-thione. Following Lipinski's Rule of Five, 4-chloro-5-diethoxyphosphinothioyloxy-2-methylpyridazine-3-thione has 0 hydrogen bond donor(s) and 6 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 4-chloro-5-diethoxyphosphinothioyloxy-2-methylpyridazine-3-thione?
The CAS number of 4-chloro-5-diethoxyphosphinothioyloxy-2-methylpyridazine-3-thione is 72039-19-1.
What is the molecular formula of 4-chloro-5-diethoxyphosphinothioyloxy-2-methylpyridazine-3-thione?
The molecular formula of 4-chloro-5-diethoxyphosphinothioyloxy-2-methylpyridazine-3-thione is C9H14ClN2O3PS2.
What is the molecular weight of 4-chloro-5-diethoxyphosphinothioyloxy-2-methylpyridazine-3-thione?
The molecular weight of 4-chloro-5-diethoxyphosphinothioyloxy-2-methylpyridazine-3-thione is 327.99 g/mol.
Where can I buy 4-chloro-5-diethoxyphosphinothioyloxy-2-methylpyridazine-3-thione?
You can request a quote for 4-chloro-5-diethoxyphosphinothioyloxy-2-methylpyridazine-3-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-chloro-5-diethoxyphosphinothioyloxy-2-methylpyridazine-3-thione?
Yes, KEHONG BIO provides custom synthesis services for 4-chloro-5-diethoxyphosphinothioyloxy-2-methylpyridazine-3-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.