Compound 325
TL;DR: Compound 325 (CAS 5827-04-3) is a chemical compound with molecular formula C11H26NO2PS4 and molecular weight 363.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dipropoxyphosphinothioyl N,N-diethylcarbamodithioate;sulfane
Also Known As: Compound 325, Holcomb compound 325, O,O-Diisopropyl S-(diethylthiocarbamyl)thiothionophosphate hydrosulfide, O,O-Diisopropyl-S-(diethylthiocarbamyl)phosphorodithioate hydrosulfide, Carbamic acid, diethyldithio-, anhydrosulfide with O,O-dipropylphosphorodithioate, compd. with hydrogen sulfide (1:1)
| Molecular Formula | C11H26NO2PS4 |
|---|---|
| Molecular Weight | 363.06 g/mol |
| LogP | 4.54 |
| Topological Polar Surface Area | 112.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 363.0584 |
| Heavy Atoms | 19 |
| Complexity | 273.0 |
Chemical Identifiers
| CAS Number | 5827-04-3 |
|---|---|
| SMILES | CCCOP(=S)(OCCC)SC(=S)N(CC)CC.S |
| InChIKey | BFXLJWUGRPGMFU-UHFFFAOYSA-N |
Product Overview
Compound 325 (CAS 5827-04-3), with molecular formula C11H26NO2PS4 and molecular weight 363.06 g/mol. IUPAC: dipropoxyphosphinothioyl N,N-diethylcarbamodithioate;sulfane.
Chemical Property Profile of Compound 325
Property Insights of Compound 325
The XLogP value of 4.54 indicates that Compound 325 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Compound 325. Following Lipinski's Rule of Five, Compound 325 has 1 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 Compound 325?
The CAS number of Compound 325 is 5827-04-3.
What is the molecular formula of Compound 325?
The molecular formula of Compound 325 is C11H26NO2PS4.
What is the molecular weight of Compound 325?
The molecular weight of Compound 325 is 363.06 g/mol.
Where can I buy Compound 325?
You can request a quote for Compound 325 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Compound 325?
Yes, KEHONG BIO provides custom synthesis services for Compound 325 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.