TL;DR: Bayer 60737 (CAS 1970-15-6) is a chemical compound with molecular formula C12H18NO5PS2 and molecular weight 351.0364 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
diethoxy-(3-ethylsulfanyl-4-nitrophenoxy)-sulfanylidene-λ5-phosphane
Also Known As: Bayer 60737, BAY 60737, Phosphorothioic acid, O,O-diethyl O-(3-(ethylthio)-4-nitrophenyl) ester, o,o-diethyl o-[3-(ethylsulfanyl)-4-nitrophenyl] phosphorothioate, diethoxy-(3-ethylsulfanyl-4-nitrophenoxy)-sulfanylidene-
| Molecular Formula | C12H18NO5PS2 |
| Molecular Weight | 351.0364 g/mol |
| XLogP | 4.5 |
| Topological Polar Surface Area (TPSA) | 131.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 351.0364 Da |
| Heavy Atoms | 21 |
| Complexity | 369.0 |
| SMILES | CCOP(=S)(OCC)OC1=CC(=C(C=C1)[N+](=O)[O-])SCC |
| InChIKey | IUBZPGNLBANILH-UHFFFAOYSA-N |
The XLogP value of 4.5 indicates that Bayer 60737 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 131.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Bayer 60737. Following Lipinski's Rule of Five, Bayer 60737 has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Bayer 60737 is 1970-15-6.
The molecular formula of Bayer 60737 is C12H18NO5PS2.
The molecular weight of Bayer 60737 is 351.0364 g/mol.
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