TL;DR: (R)-1-Boc-2-tert-butyl-3-methyl-4-imidazolidinone (CAS 119838-44-7) is a chemical compound with molecular formula C13H24N2O3 and molecular weight 256.17868 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
tert-butyl 2-tert-butyl-3-methyl-4-oxoimidazolidine-1-carboxylate
Also Known As: 4-ISOPROPYLCATECHOL, 1-Amino-2-methylnaphthalene, 4CH-019011, (S)-1-Boc-2-tert-butyl-3-methyl-4-imidazolidinone, (S)-tert-Butyl 2-(tert-butyl)-3-methyl-4-oxoimidazolidine-1-carboxylate
Top 5 of 5 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C13H24N2O3 |
| Molecular Weight | 256.17868 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 49.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 256.17868 Da |
| Heavy Atoms | 18 |
| Complexity | 352.0 |
| SMILES | CC(C)(C)C1N(C(=O)CN1C(=O)OC(C)(C)C)C |
| InChIKey | HJJLVATZPPJBNG-UHFFFAOYSA-N |
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (R)-1-Boc-2-tert-butyl-3-methyl-4-imidazolidinone. With a topological polar surface area (TPSA) of 49.9 Ų, (R)-1-Boc-2-tert-butyl-3-methyl-4-imidazolidinone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (R)-1-Boc-2-tert-butyl-3-methyl-4-imidazolidinone 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 (R)-1-Boc-2-tert-butyl-3-methyl-4-imidazolidinone is 119838-44-7.
The molecular formula of (R)-1-Boc-2-tert-butyl-3-methyl-4-imidazolidinone is C13H24N2O3.
The molecular weight of (R)-1-Boc-2-tert-butyl-3-methyl-4-imidazolidinone is 256.17868 g/mol.
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