TL;DR: Phosphamidon (CAS 13171-21-6) is a chemical compound with molecular formula C10H19ClNO5P and molecular weight 299.06894 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[3-chloro-4-(diethylamino)-4-oxobut-2-en-2-yl] dimethyl phosphate
Also Known As: PHOSPHAMIDON, Dimecron, Phosphamidone, Fosfamidon, Fosfamidone
Top 5 of 20 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C10H19ClNO5P |
| Molecular Weight | 299.06894 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 65.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 299.06894 Da |
| Heavy Atoms | 18 |
| Complexity | 359.0 |
| Melting Point | -49 °F (EPA, 1998) |
| Boiling Point | 324 °F at 1.5 mmHg (EPA, 1998) |
| Density | 1.2132 at 77 °F (EPA, 1998) - Denser than water; will sink |
| Flash Point | greater than 200 °F (NTP, 1992) |
| Vapor Pressure | 2.5e-05 mmHg at 68 °F (EPA, 1998) |
| Refractive Index | Index of refraction: 1.4718 @ 25 °C/D |
| Solubility | greater than or equal to 100 mg/mL at 72 °F (NTP, 1992) |
| SMILES | CCN(CC)C(=O)C(=C(C)OP(=O)(OC)OC)Cl |
| InChIKey | RGCLLPNLLBQHPF-UHFFFAOYSA-N |
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phosphamidon. The TPSA of 65.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Phosphamidon. Following Lipinski's Rule of Five, Phosphamidon has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Phosphamidon is 13171-21-6.
The molecular formula of Phosphamidon is C10H19ClNO5P.
The molecular weight of Phosphamidon is 299.06894 g/mol.
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