TL;DR: AO-854/40872031 (CAS 1260594-57-7) 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.
(2R)-2-[(9H-fluoren-9-ylmethoxycarbonylamino)methyl]-3-(4-methoxyphenyl)propanoic acid
Also Known As: AO-854/40872031, fmoc-(r)-3-amino-2-(4-methoxybenzyl)propanoic acid, (R)-3-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-2-(4-methoxybenzyl)propanoic acid
| 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)C[C@H](CNC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24)C(=O)O |
| InChIKey | MXXOXLANWBNXFB-GOSISDBHSA-N |
The XLogP value of 4.5 indicates that AO-854/40872031 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 AO-854/40872031. Following Lipinski's Rule of Five, AO-854/40872031 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 AO-854/40872031 is 1260594-57-7.
The molecular formula of AO-854/40872031 is C26H25NO5.
The molecular weight of AO-854/40872031 is 431.17328 g/mol.
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