TL;DR: 2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-(4-iodophenyl)propanoic Acid (CAS 1105045-73-5) is a chemical compound with molecular formula C24H20INO4 and molecular weight 513.0437 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-(4-iodophenyl)propanoic acid
Also Known As: Fmoc-4-iodo-D-phenylalanine, Fmoc-4-iodo-L-phenylalanine, Fmoc-D-Phe(4-I)-OH, Fmoc-Phe(4-I)-OH, Fmoc-D-4-Iodophe
| Molecular Formula | C24H20INO4 |
| Molecular Weight | 513.0437 g/mol |
| XLogP | 5.3 |
| Topological Polar Surface Area (TPSA) | 75.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 513.0437 Da |
| Heavy Atoms | 30 |
| Complexity | 584.0 |
| SMILES | C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)NC(CC4=CC=C(C=C4)I)C(=O)O |
| InChIKey | LXOXXTQKKRJNNB-UHFFFAOYSA-N |
The XLogP value of 5.3 indicates that 2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-(4-iodophenyl)propanoic Acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-(4-iodophenyl)propanoic Acid. Following Lipinski's Rule of Five, 2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-(4-iodophenyl)propanoic Acid has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-(4-iodophenyl)propanoic Acid is 1105045-73-5.
The molecular formula of 2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-(4-iodophenyl)propanoic Acid is C24H20INO4.
The molecular weight of 2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-(4-iodophenyl)propanoic Acid is 513.0437 g/mol.
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