TL;DR: 2,5-Pyrrolidinedione, 3-phenyl-1-(3-pyridinylmethyl)- (CAS 132458-98-1) is a chemical compound with molecular formula C16H14N2O2 and molecular weight 266.10553 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-phenyl-1-(pyridin-3-ylmethyl)pyrrolidine-2,5-dione
Also Known As: 3-Phenyl-1-(3-pyridinylmethyl)-2,5-pyrrolidinedione, alpha-Phenylsuccinic acid N-(3-pyridylmethyl)imide, 3-phenyl-1-(pyridin-3-ylmethyl)pyrrolidine-2,5-dione, 2,5-Pyrrolidinedione, 3-phenyl-1-(3-pyridinylmethyl)-, 3-Phenyl-1-[(pyridin-3-yl)methyl]pyrrolidine-2,5-dione
| Molecular Formula | C16H14N2O2 |
| Molecular Weight | 266.10553 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 50.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 266.10553 Da |
| Heavy Atoms | 20 |
| Complexity | 377.0 |
| SMILES | C1C(C(=O)N(C1=O)CC2=CN=CC=C2)C3=CC=CC=C3 |
| InChIKey | GCTIDCUYRLPLSW-UHFFFAOYSA-N |
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,5-Pyrrolidinedione, 3-phenyl-1-(3-pyridinylmethyl)-. With a topological polar surface area (TPSA) of 50.3 Ų, 2,5-Pyrrolidinedione, 3-phenyl-1-(3-pyridinylmethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,5-Pyrrolidinedione, 3-phenyl-1-(3-pyridinylmethyl)- has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2,5-Pyrrolidinedione, 3-phenyl-1-(3-pyridinylmethyl)- is 132458-98-1.
The molecular formula of 2,5-Pyrrolidinedione, 3-phenyl-1-(3-pyridinylmethyl)- is C16H14N2O2.
The molecular weight of 2,5-Pyrrolidinedione, 3-phenyl-1-(3-pyridinylmethyl)- is 266.10553 g/mol.
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