TL;DR: 1-[4-(difluoromethoxy)phenyl]-3-{[4-(morpholin-4-yl)phenyl]amino}pyrrolidine-2,5-dione (CAS 1008678-07-6) is a chemical compound with molecular formula C21H21F2N3O4 and molecular weight 417.15002 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[4-(difluoromethoxy)phenyl]-3-(4-morpholin-4-ylanilino)pyrrolidine-2,5-dione
Also Known As: 1-[4-(difluoromethoxy)phenyl]-3-{[4-(morpholin-4-yl)phenyl]amino}pyrrolidine-2,5-dione, 1-(4-(difluoromethoxy)phenyl)-3-((4-morpholinophenyl)amino)pyrrolidine-2,5-dione, 1-[4-(difluoromethoxy)phenyl]-3-(4-morpholin-4-ylanilino)pyrrolidine-2,5-dione, F1593-0044, 1-[4-(difluoromethoxy)phenyl]-3-[(4-morpholin-4-ylphenyl)amino]azolidine-2,5-d ione
| Molecular Formula | C21H21F2N3O4 |
| Molecular Weight | 417.15002 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 71.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 417.15002 Da |
| Heavy Atoms | 30 |
| Complexity | 601.0 |
| SMILES | C1COCCN1C2=CC=C(C=C2)NC3CC(=O)N(C3=O)C4=CC=C(C=C4)OC(F)F |
| InChIKey | XUSGMFOENRTCME-UHFFFAOYSA-N |
The XLogP value of 3.2 indicates that 1-[4-(difluoromethoxy)phenyl]-3-{[4-(morpholin-4-yl)phenyl]amino}pyrrolidine-2,5-dione 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 1-[4-(difluoromethoxy)phenyl]-3-{[4-(morpholin-4-yl)phenyl]amino}pyrrolidine-2,5-dione. Following Lipinski's Rule of Five, 1-[4-(difluoromethoxy)phenyl]-3-{[4-(morpholin-4-yl)phenyl]amino}pyrrolidine-2,5-dione has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-[4-(difluoromethoxy)phenyl]-3-{[4-(morpholin-4-yl)phenyl]amino}pyrrolidine-2,5-dione is 1008678-07-6.
The molecular formula of 1-[4-(difluoromethoxy)phenyl]-3-{[4-(morpholin-4-yl)phenyl]amino}pyrrolidine-2,5-dione is C21H21F2N3O4.
The molecular weight of 1-[4-(difluoromethoxy)phenyl]-3-{[4-(morpholin-4-yl)phenyl]amino}pyrrolidine-2,5-dione is 417.15002 g/mol.
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