TL;DR: (S)-N-Cbz-4-methyl-5-oxooxazolidine (CAS 1272756-25-8) is a chemical compound with molecular formula C12H13NO4 and molecular weight 235.08446 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
benzyl (4S)-4-methyl-5-oxo-1,3-oxazolidine-3-carboxylate
Also Known As: (S)-N-Cbz-4-methyl-5-oxooxazolidine, Metaraminol Impurity 64, benzyl (4S)-4-methyl-5-oxo-1,3-oxazolidine-3-carboxylate, 4852AJ, J1.042.816E
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C12H13NO4 |
| Molecular Weight | 235.08446 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 55.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 235.08446 Da |
| Heavy Atoms | 17 |
| Complexity | 299.0 |
| SMILES | C[C@H]1C(=O)OCN1C(=O)OCC2=CC=CC=C2 |
| InChIKey | RPPNACKXIUVYEF-VIFPVBQESA-N |
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-N-Cbz-4-methyl-5-oxooxazolidine. With a topological polar surface area (TPSA) of 55.8 Ų, (S)-N-Cbz-4-methyl-5-oxooxazolidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (S)-N-Cbz-4-methyl-5-oxooxazolidine 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 (S)-N-Cbz-4-methyl-5-oxooxazolidine is 1272756-25-8.
The molecular formula of (S)-N-Cbz-4-methyl-5-oxooxazolidine is C12H13NO4.
The molecular weight of (S)-N-Cbz-4-methyl-5-oxooxazolidine is 235.08446 g/mol.
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