Bayer 50536
TL;DR: Bayer 50536 (CAS 18151-09-2) is a chemical compound with molecular formula C11H16ClO2PS2 and molecular weight 310.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-chloro-3-methylphenyl)sulfanyl-diethoxy-sulfanylidene-λ5-phosphane
Also Known As: Bayer 50536, Phosphorodithioic acid, S-(4-chloro-3-methylphenyl) O,O-diethyl ester, Phosphorodithioic acid, S-(4-chloro-m-tolyl) O,O-diethyl ester, (4-chloro-3-methylphenyl)sulfanyl-diethoxy-sulfanylidene-, S-(4-Chloro-3-methylphenyl) O,O-diethyl phosphorodithioate
| Molecular Formula | C11H16ClO2PS2 |
|---|---|
| Molecular Weight | 310.00 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 75.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 310.0018 |
| Heavy Atoms | 17 |
| Complexity | 268.0 |
Chemical Identifiers
| CAS Number | 18151-09-2 |
|---|---|
| SMILES | CCOP(=S)(OCC)SC1=CC(=C(C=C1)Cl)C |
| InChIKey | HTIIPZOLMCOBIW-UHFFFAOYSA-N |
Product Overview
Bayer 50536 (CAS 18151-09-2), with molecular formula C11H16ClO2PS2 and molecular weight 310.00 g/mol. IUPAC: (4-chloro-3-methylphenyl)sulfanyl-diethoxy-sulfanylidene-λ5-phosphane.
Chemical Property Profile of Bayer 50536
Property Insights of Bayer 50536
The XLogP value of 4.9 indicates that Bayer 50536 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Bayer 50536. Following Lipinski's Rule of Five, Bayer 50536 has 0 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 Bayer 50536?
The CAS number of Bayer 50536 is 18151-09-2.
What is the molecular formula of Bayer 50536?
The molecular formula of Bayer 50536 is C11H16ClO2PS2.
What is the molecular weight of Bayer 50536?
The molecular weight of Bayer 50536 is 310.00 g/mol.
Where can I buy Bayer 50536?
You can request a quote for Bayer 50536 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bayer 50536?
Yes, KEHONG BIO provides custom synthesis services for Bayer 50536 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.