TL;DR: Methyl 4-(4-methoxyphenyl)-2-oxopyrrolidine-3-carboxylate (CAS 100373-19-1) is a chemical compound with molecular formula C13H15NO4 and molecular weight 249.10011 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 4-(4-methoxyphenyl)-2-oxopyrrolidine-3-carboxylate
Also Known As: methyl 4-(4-methoxyphenyl)-2-oxopyrrolidine-3-carboxylate, AB00080498-01, F2147-0252, methyl4-(4-methoxyphenyl)-2-oxopyrrolidine-3-carboxylate, methyl 4-(4-methoxyphenyl)-2-oxo-3-pyrrolidinecarboxylate
| Molecular Formula | C13H15NO4 |
| Molecular Weight | 249.10011 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 64.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 249.10011 Da |
| Heavy Atoms | 18 |
| Complexity | 323.0 |
| SMILES | COC1=CC=C(C=C1)C2CNC(=O)C2C(=O)OC |
| InChIKey | DEQYSMOBGAWMAL-UHFFFAOYSA-N |
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 4-(4-methoxyphenyl)-2-oxopyrrolidine-3-carboxylate. The TPSA of 64.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 4-(4-methoxyphenyl)-2-oxopyrrolidine-3-carboxylate. Following Lipinski's Rule of Five, Methyl 4-(4-methoxyphenyl)-2-oxopyrrolidine-3-carboxylate has 1 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 Methyl 4-(4-methoxyphenyl)-2-oxopyrrolidine-3-carboxylate is 100373-19-1.
The molecular formula of Methyl 4-(4-methoxyphenyl)-2-oxopyrrolidine-3-carboxylate is C13H15NO4.
The molecular weight of Methyl 4-(4-methoxyphenyl)-2-oxopyrrolidine-3-carboxylate is 249.10011 g/mol.
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