TL;DR: Fmoc-(S)-3-amino-3-(2-furyl)-propionic acid (CAS 159611-02-6) is a chemical compound with molecular formula C22H19NO5 and molecular weight 377.1263 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3S)-3-(9H-fluoren-9-ylmethoxycarbonylamino)-3-(furan-2-yl)propanoic acid
Also Known As: Fmoc-(S)-3-amino-3-(2-furyl)-propionic acid, RARECHEM AK HF S198, (S)-3-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-3-(furan-2-yl)propanoic acid, Fmoc-D-, A-Ala-(2-furyl)-OH
| Molecular Formula | C22H19NO5 |
| Molecular Weight | 377.1263 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 88.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 377.1263 Da |
| Heavy Atoms | 28 |
| Complexity | 545.0 |
| SMILES | C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@@H](CC(=O)O)C4=CC=CO4 |
| InChIKey | WNBKREXSNCMGTJ-IBGZPJMESA-N |
The XLogP value of 3.2 indicates that Fmoc-(S)-3-amino-3-(2-furyl)-propionic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Fmoc-(S)-3-amino-3-(2-furyl)-propionic acid. Following Lipinski's Rule of Five, Fmoc-(S)-3-amino-3-(2-furyl)-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 Fmoc-(S)-3-amino-3-(2-furyl)-propionic acid is 159611-02-6.
The molecular formula of Fmoc-(S)-3-amino-3-(2-furyl)-propionic acid is C22H19NO5.
The molecular weight of Fmoc-(S)-3-amino-3-(2-furyl)-propionic acid is 377.1263 g/mol.
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