TL;DR: (R)-2-((tert-Butoxycarbonyl)amino)-3-(tetrahydro-2H-pyran-4-yl)propanoic acid (CAS 1393524-16-7) is a chemical compound with molecular formula C13H23NO5 and molecular weight 273.15762 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(oxan-4-yl)propanoic acid
Also Known As: (R)-2-((tert-Butoxycarbonyl)amino)-3-(tetrahydro-2H-pyran-4-yl)propanoic acid, (2R)-2-{[(tert-Butoxy)carbonyl]amino}-3-(oxan-4-yl)propanoic acid, (2R)-2-{[(tert-butoxy)carbonyl]amino}-3-(oxan-4-yl)propanoicacid, (2R)-2-(tert-butoxycarbonylamino)-3-tetrahydropyran-4-yl-propanoic acid, (2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(oxan-4-yl)propanoic acid
| Molecular Formula | C13H23NO5 |
| Molecular Weight | 273.15762 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 84.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 273.15762 Da |
| Heavy Atoms | 19 |
| Complexity | 317.0 |
| SMILES | CC(C)(C)OC(=O)N[C@H](CC1CCOCC1)C(=O)O |
| InChIKey | NKYZORHKIYSSEL-SNVBAGLBSA-N |
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (R)-2-((tert-Butoxycarbonyl)amino)-3-(tetrahydro-2H-pyran-4-yl)propanoic acid. The TPSA of 84.9 Ų falls within the moderate polarity range, balancing permeability and solubility for (R)-2-((tert-Butoxycarbonyl)amino)-3-(tetrahydro-2H-pyran-4-yl)propanoic acid. Following Lipinski's Rule of Five, (R)-2-((tert-Butoxycarbonyl)amino)-3-(tetrahydro-2H-pyran-4-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)-2-((tert-Butoxycarbonyl)amino)-3-(tetrahydro-2H-pyran-4-yl)propanoic acid is 1393524-16-7.
The molecular formula of (R)-2-((tert-Butoxycarbonyl)amino)-3-(tetrahydro-2H-pyran-4-yl)propanoic acid is C13H23NO5.
The molecular weight of (R)-2-((tert-Butoxycarbonyl)amino)-3-(tetrahydro-2H-pyran-4-yl)propanoic acid is 273.15762 g/mol.
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