TL;DR: 2-(Morpholin-4-ylmethyl)isoindole-1,3-dione (CAS 105735-68-0) is a chemical compound with molecular formula C13H14N2O3 and molecular weight 246.10045 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(morpholin-4-ylmethyl)isoindole-1,3-dione
Also Known As: 2-(morpholin-4-ylmethyl)isoindole-1,3-dione, N-(morpholinomethyl)phthalimide, 2-Morpholin-4-ylmethyl-isoindole-1,3-dione, 2-(morpholinomethyl)isoindoline-1,3-dione, BAS 00121192
| Molecular Formula | C13H14N2O3 |
| Molecular Weight | 246.10045 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 49.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 246.10045 Da |
| Heavy Atoms | 18 |
| Complexity | 328.0 |
| SMILES | C1COCCN1CN2C(=O)C3=CC=CC=C3C2=O |
| InChIKey | WYOAWPIAOVAVTO-UHFFFAOYSA-N |
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Morpholin-4-ylmethyl)isoindole-1,3-dione. With a topological polar surface area (TPSA) of 49.9 Ų, 2-(Morpholin-4-ylmethyl)isoindole-1,3-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Morpholin-4-ylmethyl)isoindole-1,3-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 2-(Morpholin-4-ylmethyl)isoindole-1,3-dione is 105735-68-0.
The molecular formula of 2-(Morpholin-4-ylmethyl)isoindole-1,3-dione is C13H14N2O3.
The molecular weight of 2-(Morpholin-4-ylmethyl)isoindole-1,3-dione is 246.10045 g/mol.
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