TL;DR: (R)-3-((tert-Butoxycarbonyl)amino)-3-(furan-2-yl)propanoic acid (CAS 1217725-33-1) is a chemical compound with molecular formula C12H17NO5 and molecular weight 255.11067 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3R)-3-(furan-2-yl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid
Also Known As: (R)-3-((tert-Butoxycarbonyl)amino)-3-(furan-2-yl)propanoic acid, Boc-(R)-3-amino-3-(2-furyl)-propionic acid, Boc-, A-Ala-(2-Furyl)-OH, Boc-Gly(2-Furyl)-(C#CH2)OH
| Molecular Formula | C12H17NO5 |
| Molecular Weight | 255.11067 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 88.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 255.11067 Da |
| Heavy Atoms | 18 |
| Complexity | 310.0 |
| SMILES | CC(C)(C)OC(=O)N[C@H](CC(=O)O)C1=CC=CO1 |
| InChIKey | NTIWANHPRXTWCF-MRVPVSSYSA-N |
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (R)-3-((tert-Butoxycarbonyl)amino)-3-(furan-2-yl)propanoic acid. The TPSA of 88.8 Ų falls within the moderate polarity range, balancing permeability and solubility for (R)-3-((tert-Butoxycarbonyl)amino)-3-(furan-2-yl)propanoic acid. Following Lipinski's Rule of Five, (R)-3-((tert-Butoxycarbonyl)amino)-3-(furan-2-yl)propanoic acid has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (R)-3-((tert-Butoxycarbonyl)amino)-3-(furan-2-yl)propanoic acid is 1217725-33-1.
The molecular formula of (R)-3-((tert-Butoxycarbonyl)amino)-3-(furan-2-yl)propanoic acid is C12H17NO5.
The molecular weight of (R)-3-((tert-Butoxycarbonyl)amino)-3-(furan-2-yl)propanoic acid is 255.11067 g/mol.
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