TL;DR: 3-(1,3-Benzodioxol-5-ylamino)pyrrolidine-2,5-dione (CAS 1008268-25-4) is a chemical compound with molecular formula C11H10N2O4 and molecular weight 234.06406 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(1,3-benzodioxol-5-ylamino)pyrrolidine-2,5-dione
Also Known As: 3-(1,3-benzodioxol-5-ylamino)pyrrolidine-2,5-dione, AS-871/43476203, 3-(1,3-benzodioxol-5-ylamino)-2,5-pyrrolidinedione, F3188-0120, 3-(benzo[d][1,3]dioxol-5-ylamino)pyrrolidine-2,5-dione
| Molecular Formula | C11H10N2O4 |
| Molecular Weight | 234.06406 g/mol |
| XLogP | 0.6 |
| Topological Polar Surface Area (TPSA) | 76.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 234.06406 Da |
| Heavy Atoms | 17 |
| Complexity | 346.0 |
| SMILES | C1C(C(=O)NC1=O)NC2=CC3=C(C=C2)OCO3 |
| InChIKey | MOSNXFUKKWEFMC-UHFFFAOYSA-N |
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(1,3-Benzodioxol-5-ylamino)pyrrolidine-2,5-dione. The TPSA of 76.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(1,3-Benzodioxol-5-ylamino)pyrrolidine-2,5-dione. Following Lipinski's Rule of Five, 3-(1,3-Benzodioxol-5-ylamino)pyrrolidine-2,5-dione has 2 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 3-(1,3-Benzodioxol-5-ylamino)pyrrolidine-2,5-dione is 1008268-25-4.
The molecular formula of 3-(1,3-Benzodioxol-5-ylamino)pyrrolidine-2,5-dione is C11H10N2O4.
The molecular weight of 3-(1,3-Benzodioxol-5-ylamino)pyrrolidine-2,5-dione is 234.06406 g/mol.
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