TL;DR: FMOC-3-PAL-OH (CAS 142994-45-4) is a chemical compound with molecular formula C23H20N2O4 and molecular weight 388.1423 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-pyridin-3-ylpropanoic acid
Also Known As: FMOC-3-PAL-OH, Fmoc-3-(3-pyridyl)-L-alanine, Fmoc-L-3-Pyridylalanine, Atorvastatin Impurity 111, Fmoc-L-3-(3-pyridyl)-alanine
| Molecular Formula | C23H20N2O4 |
| Molecular Weight | 388.1423 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 88.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 388.1423 Da |
| Heavy Atoms | 29 |
| Complexity | 561.0 |
| SMILES | C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@@H](CC4=CN=CC=C4)C(=O)O |
| InChIKey | JQLPMTXRCLXOJO-NRFANRHFSA-N |
The XLogP value of 3.6 indicates that FMOC-3-PAL-OH is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.5 Ų falls within the moderate polarity range, balancing permeability and solubility for FMOC-3-PAL-OH. Following Lipinski's Rule of Five, FMOC-3-PAL-OH 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-3-PAL-OH is 142994-45-4.
The molecular formula of FMOC-3-PAL-OH is C23H20N2O4.
The molecular weight of FMOC-3-PAL-OH is 388.1423 g/mol.
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