TL;DR: Disoxaril (CAS 87495-31-6) is a chemical compound with molecular formula C20H26N2O3 and molecular weight 342.19434 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-[7-[4-(4,5-dihydro-1,3-oxazol-2-yl)phenoxy]heptyl]-3-methyl-1,2-oxazole
Also Known As: DISOXARIL, Compound IV, Disoxarilo, Disoxarilum, Disoxarilum [Latin]
Top 5 of 11 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C20H26N2O3 |
| Molecular Weight | 342.19434 g/mol |
| XLogP | 4.4 |
| Topological Polar Surface Area (TPSA) | 56.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 342.19434 Da |
| Heavy Atoms | 25 |
| Complexity | 408.0 |
| SMILES | CC1=NOC(=C1)CCCCCCCOC2=CC=C(C=C2)C3=NCCO3 |
| InChIKey | FKLJPTJMIBLJAV-UHFFFAOYSA-N |
The XLogP value of 4.4 indicates that Disoxaril is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.9 Ų, Disoxaril exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Disoxaril 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 Disoxaril is 87495-31-6.
The molecular formula of Disoxaril is C20H26N2O3.
The molecular weight of Disoxaril is 342.19434 g/mol.
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