TL;DR: Phosphoramidothioic acid, O,O-diethyl ester (CAS 17321-48-1) is a chemical compound with molecular formula C4H12NO2PS and molecular weight 169.03264 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[amino(ethoxy)phosphinothioyl]oxyethane
Also Known As: O,O-Diethyl phosphoramidothioate, O,O-Diethyl thiophosphoramidate, [amino(ethoxy)phosphinothioyl]oxyethane, Phosphoramidothioic acid, O,O-diethyl ester, O,O-Diethyl amidothiophosphate #
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C4H12NO2PS |
| Molecular Weight | 169.03264 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 76.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 169.03264 Da |
| Heavy Atoms | 9 |
| Complexity | 109.0 |
| SMILES | CCOP(=S)(N)OCC |
| InChIKey | LAGRCNJEUAJJQC-UHFFFAOYSA-N |
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phosphoramidothioic acid, O,O-diethyl ester. The TPSA of 76.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Phosphoramidothioic acid, O,O-diethyl ester. Following Lipinski's Rule of Five, Phosphoramidothioic acid, O,O-diethyl ester has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Phosphoramidothioic acid, O,O-diethyl ester is 17321-48-1.
The molecular formula of Phosphoramidothioic acid, O,O-diethyl ester is C4H12NO2PS.
The molecular weight of Phosphoramidothioic acid, O,O-diethyl ester is 169.03264 g/mol.
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