TL;DR: Boc-D-threo-3-(3-methoxyphenyl)serine (CAS 1391468-63-5) is a chemical compound with molecular formula C15H21NO6 and molecular weight 311.1369 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S,3R)-3-hydroxy-3-(3-methoxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid
Also Known As: Boc-D-threo-3-(3-methoxyphenyl)serine, (2S,3R)-3-hydroxy-3-(3-methoxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid, (2S,3R)-2-(tert-butoxycarbonylamino)-3-hydroxy-3-(3-methoxyphenyl)propanoic acid, (2S,3S)-3-hydroxy-3-(3-methoxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic Acid
| Molecular Formula | C15H21NO6 |
| Molecular Weight | 311.1369 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 105.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 311.1369 Da |
| Heavy Atoms | 22 |
| Complexity | 392.0 |
| SMILES | CC(C)(C)OC(=O)N[C@@H]([C@@H](C1=CC(=CC=C1)OC)O)C(=O)O |
| InChIKey | YWXAADJDDXPSLZ-NWDGAFQWSA-N |
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Boc-D-threo-3-(3-methoxyphenyl)serine. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Boc-D-threo-3-(3-methoxyphenyl)serine. Following Lipinski's Rule of Five, Boc-D-threo-3-(3-methoxyphenyl)serine has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Boc-D-threo-3-(3-methoxyphenyl)serine is 1391468-63-5.
The molecular formula of Boc-D-threo-3-(3-methoxyphenyl)serine is C15H21NO6.
The molecular weight of Boc-D-threo-3-(3-methoxyphenyl)serine is 311.1369 g/mol.
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