Bayer 52752
TL;DR: Bayer 52752 (CAS 82980-44-7) is a chemical compound with molecular formula C12H19O3PS2 and molecular weight 306.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methoxy-(3-methyl-4-methylsulfinylphenoxy)-propan-2-yl-sulfanylidene-λ5-phosphane
Also Known As: Bayer 52752, BAY 52752, (1-Methylethyl)phosphonothioic acid O-methyl O-(3-methyl-4-(methylsulfinyl)phenyl) ester, Phosphonothioic acid, (1-methylethyl)-, O-methyl O-(3-methyl-4-(methylsulfinyl)phenyl) ester, methoxy-(3-methyl-4-methylsulfinylphenoxy)-propan-2-yl-sulfanylidene-
| Molecular Formula | C12H19O3PS2 |
|---|---|
| Molecular Weight | 306.05 g/mol |
| LogP | 3.47552 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 306.05133 |
| Heavy Atoms | 18 |
| Complexity | 500.09595 |
Chemical Identifiers
| CAS Number | 82980-44-7 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)OP(=S)(C(C)C)OC)S(=O)C |
Product Overview
Bayer 52752 (CAS 82980-44-7), with molecular formula C12H19O3PS2 and molecular weight 306.05 g/mol. IUPAC: methoxy-(3-methyl-4-methylsulfinylphenoxy)-propan-2-yl-sulfanylidene-λ5-phosphane.
Chemical Property Profile of Bayer 52752
Property Insights of Bayer 52752
The XLogP value of 3.47552 indicates that Bayer 52752 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.53 Ų, Bayer 52752 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bayer 52752 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 52752?
The CAS number of Bayer 52752 is 82980-44-7.
What is the molecular formula of Bayer 52752?
The molecular formula of Bayer 52752 is C12H19O3PS2.
What is the molecular weight of Bayer 52752?
The molecular weight of Bayer 52752 is 306.05 g/mol.
Where can I buy Bayer 52752?
You can request a quote for Bayer 52752 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bayer 52752?
Yes, KEHONG BIO provides custom synthesis services for Bayer 52752 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.