TL;DR: (4R)-1-(tert-Butoxycarbonyl)-4-phenyl-L-proline (CAS 144069-70-5) is a chemical compound with molecular formula C16H21NO4 and molecular weight 291.14706 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S,4R)-1-[(2-methylpropan-2-yl)oxycarbonyl]-4-phenylpyrrolidine-2-carboxylic acid
Also Known As: (2S,4R)-1-(tert-butoxycarbonyl)-4-phenylpyrrolidine-2-carboxylic acid, (2S,4R)-Boc-4-phenyl-pyrrolidine-2-carboxylic acid, (2S,4R)-Boc-4-phenyl-Pro-OH, Boc-trans-4-phenyl-L-proline, (2S,4R)-1-[(2-methylpropan-2-yl)oxycarbonyl]-4-phenylpyrrolidine-2-carboxylic acid
| Molecular Formula | C16H21NO4 |
| Molecular Weight | 291.14706 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 66.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 291.14706 Da |
| Heavy Atoms | 21 |
| Complexity | 396.0 |
| SMILES | CC(C)(C)OC(=O)N1C[C@H](C[C@H]1C(=O)O)C2=CC=CC=C2 |
| InChIKey | JDAQDIQHICLYKH-STQMWFEESA-N |
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4R)-1-(tert-Butoxycarbonyl)-4-phenyl-L-proline. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for (4R)-1-(tert-Butoxycarbonyl)-4-phenyl-L-proline. Following Lipinski's Rule of Five, (4R)-1-(tert-Butoxycarbonyl)-4-phenyl-L-proline 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 (4R)-1-(tert-Butoxycarbonyl)-4-phenyl-L-proline is 144069-70-5.
The molecular formula of (4R)-1-(tert-Butoxycarbonyl)-4-phenyl-L-proline is C16H21NO4.
The molecular weight of (4R)-1-(tert-Butoxycarbonyl)-4-phenyl-L-proline is 291.14706 g/mol.
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