Bayer 45522
TL;DR: Bayer 45522 (CAS 63815-54-3) is a chemical compound with molecular formula C9H15N2O2PS2 and molecular weight 278.03125 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2-ethylsulfanyl-6-methylpyrimidin-4-yl)oxy-methoxy-methyl-sulfanylidene-λ5-phosphane
Also Known As: Bayer 45522, BAY 45522, O-(2-(Ethylthio)-6-methyl-4-pyrimidinyl) O-methyl methylphosphonothioate, o-[2-(ethylsulfanyl)-6-methylpyrimidin-4-yl] o-methyl methylphosphonothioate, Phosphonothioic acid, methyl-, O-(2-(ethylthio)-6-methyl-4-pyrimidinyl) O-methyl ester
Technical Specifications
| Molecular Formula | C9H15N2O2PS2 |
| Molecular Weight | 278.03125 g/mol |
| XLogP | 4.2 |
| Topological Polar Surface Area (TPSA) | 102.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 278.03125 Da |
| Heavy Atoms | 16 |
| Complexity | 268.0 |
| SMILES | CCSC1=NC(=CC(=N1)OP(=S)(C)OC)C |
| InChIKey | HDYKJFNCNQBNTR-UHFFFAOYSA-N |
Chemical Property Profile of Bayer 45522
Property Insights of Bayer 45522
The XLogP value of 4.2 indicates that Bayer 45522 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Bayer 45522. Following Lipinski's Rule of Five, Bayer 45522 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
What is the CAS number of Bayer 45522?
The CAS number of Bayer 45522 is 63815-54-3.
What is the molecular formula of Bayer 45522?
The molecular formula of Bayer 45522 is C9H15N2O2PS2.
What is the molecular weight of Bayer 45522?
The molecular weight of Bayer 45522 is 278.03125 g/mol.
Where can I buy Bayer 45522?
You can request a quote for Bayer 45522 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Bayer 45522?
Yes, CoreyChem provides custom synthesis services for Bayer 45522 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.