TL;DR: Difenoxuron (CAS 14214-32-5) is a chemical compound with molecular formula C16H18N2O3 and molecular weight 286.13174 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[4-(4-methoxyphenoxy)phenyl]-1,1-dimethylurea
Also Known As: DIFENOXURON, Difenoxurone, Lironion, Pinoran, Aronixil
Top 5 of 14 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C16H18N2O3 |
| Molecular Weight | 286.13174 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 50.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 286.13174 Da |
| Heavy Atoms | 21 |
| Complexity | 319.0 |
| SMILES | CN(C)C(=O)NC1=CC=C(C=C1)OC2=CC=C(C=C2)OC |
| InChIKey | AMVYOVYGIJXTQB-UHFFFAOYSA-N |
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Difenoxuron. With a topological polar surface area (TPSA) of 50.8 Ų, Difenoxuron exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Difenoxuron has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Difenoxuron is 14214-32-5.
The molecular formula of Difenoxuron is C16H18N2O3.
The molecular weight of Difenoxuron is 286.13174 g/mol.
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