TL;DR: BAS 05289062 (CAS 487038-88-0) is a chemical compound with molecular formula C26H25N3O4 and molecular weight 443.1845 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-naphthalen-1-ylpyrrolidine-2,5-dione
Also Known As: BAS 05289062, AJ-292/41685474, 3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-naphthalen-1-ylpyrrolidine-2,5-dione, 3-(4-(benzo[d][1,3]dioxol-5-ylmethyl)piperazin-1-yl)-1-(naphthalen-1-yl)pyrrolidine-2,5-dione, 3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-(1-naphthyl)pyrrolidine-2,5-dione
| Molecular Formula | C26H25N3O4 |
| Molecular Weight | 443.1845 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 62.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 443.1845 Da |
| Heavy Atoms | 33 |
| Complexity | 739.0 |
| SMILES | C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C4CC(=O)N(C4=O)C5=CC=CC6=CC=CC=C65 |
| InChIKey | RVIFBTRDKRLZQF-UHFFFAOYSA-N |
The XLogP value of 3.2 indicates that BAS 05289062 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.3 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 05289062. Following Lipinski's Rule of Five, BAS 05289062 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of BAS 05289062 is 487038-88-0.
The molecular formula of BAS 05289062 is C26H25N3O4.
The molecular weight of BAS 05289062 is 443.1845 g/mol.
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