TL;DR: (R,S)-Fmoc-3-amino-2-(4-methoxybenzyl)-propionic acid (CAS 1260614-09-2) is a chemical compound with molecular formula C26H25NO5 and molecular weight 431.17328 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(9H-fluoren-9-ylmethoxycarbonylamino)methyl]-3-(4-methoxyphenyl)propanoic acid
Also Known As: (R,S)-Fmoc-3-amino-2-(4-methoxybenzyl)-propionic acid, AO-854/40872031, A-8129, 2-[(9H-fluoren-9-ylmethoxycarbonylamino)methyl]-3-(4-methoxyphenyl)propanoic acid, (R,S)-Fmoc-3-amino-2-(4-methoxybenzyl)-propionicacid
| Molecular Formula | C26H25NO5 |
| Molecular Weight | 431.17328 g/mol |
| XLogP | 4.5 |
| Topological Polar Surface Area (TPSA) | 84.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 431.17328 Da |
| Heavy Atoms | 32 |
| Complexity | 610.0 |
| SMILES | COC1=CC=C(C=C1)CC(CNC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24)C(=O)O |
| InChIKey | MXXOXLANWBNXFB-UHFFFAOYSA-N |
The XLogP value of 4.5 indicates that (R,S)-Fmoc-3-amino-2-(4-methoxybenzyl)-propionic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.9 Ų falls within the moderate polarity range, balancing permeability and solubility for (R,S)-Fmoc-3-amino-2-(4-methoxybenzyl)-propionic acid. Following Lipinski's Rule of Five, (R,S)-Fmoc-3-amino-2-(4-methoxybenzyl)-propionic 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,S)-Fmoc-3-amino-2-(4-methoxybenzyl)-propionic acid is 1260614-09-2.
The molecular formula of (R,S)-Fmoc-3-amino-2-(4-methoxybenzyl)-propionic acid is C26H25NO5.
The molecular weight of (R,S)-Fmoc-3-amino-2-(4-methoxybenzyl)-propionic acid is 431.17328 g/mol.
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