TL;DR: 1,1'-(Dodecane-1,12-diyl)bis-1H-pyrrole-2,5-dione (CAS 27574-80-7) is a chemical compound with molecular formula C20H28N2O4 and molecular weight 360.2049 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[12-(2,5-dioxopyrrol-1-yl)dodecyl]pyrrole-2,5-dione
Also Known As: 1,1'-(Dodecane-1,12-diyl)bis-1H-pyrrole-2,5-dione, KST-1B2677, 1-[12-(2,5-dioxopyrrol-1-yl)dodecyl]pyrrole-2,5-dione, 1,1'-dodecane-1,12-diylbis(1h-pyrrole-2,5-dione), N,N -(1,12-Dodecanediyl)bis(maleimide)
Top 5 of 7 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C20H28N2O4 |
| Molecular Weight | 360.2049 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 74.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 13 |
| Exact Mass | 360.2049 Da |
| Heavy Atoms | 26 |
| Complexity | 507.0 |
| SMILES | C1=CC(=O)N(C1=O)CCCCCCCCCCCCN2C(=O)C=CC2=O |
| InChIKey | OEUTXEVXKFXZPB-UHFFFAOYSA-N |
The XLogP value of 3.4 indicates that 1,1'-(Dodecane-1,12-diyl)bis-1H-pyrrole-2,5-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,1'-(Dodecane-1,12-diyl)bis-1H-pyrrole-2,5-dione. Following Lipinski's Rule of Five, 1,1'-(Dodecane-1,12-diyl)bis-1H-pyrrole-2,5-dione has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1,1'-(Dodecane-1,12-diyl)bis-1H-pyrrole-2,5-dione is 27574-80-7.
The molecular formula of 1,1'-(Dodecane-1,12-diyl)bis-1H-pyrrole-2,5-dione is C20H28N2O4.
The molecular weight of 1,1'-(Dodecane-1,12-diyl)bis-1H-pyrrole-2,5-dione is 360.2049 g/mol.
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