TL;DR: AB00689052-01 (CAS 1008211-38-8) is a chemical compound with molecular formula C22H27N3O4 and molecular weight 397.20016 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[4-(dimethylamino)anilino]pyrrolidine-2,5-dione
Also Known As: AB00689052-01, 1-(3,4-dimethoxyphenethyl)-3-((4-(dimethylamino)phenyl)amino)pyrrolidine-2,5-dione, 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-{[4-(dimethylamino)phenyl]amino}pyrrolidine-2,5-dione, F3023-0930, 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[4-(dimethylamino)anilino]pyrrolidine-2,5-dione
| Molecular Formula | C22H27N3O4 |
| Molecular Weight | 397.20016 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 71.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 397.20016 Da |
| Heavy Atoms | 29 |
| Complexity | 562.0 |
| SMILES | CN(C)C1=CC=C(C=C1)NC2CC(=O)N(C2=O)CCC3=CC(=C(C=C3)OC)OC |
| InChIKey | DFJANFGJRJGXAO-UHFFFAOYSA-N |
The XLogP value of 3.0 indicates that AB00689052-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.1 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00689052-01. Following Lipinski's Rule of Five, AB00689052-01 has 1 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 AB00689052-01 is 1008211-38-8.
The molecular formula of AB00689052-01 is C22H27N3O4.
The molecular weight of AB00689052-01 is 397.20016 g/mol.
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