TL;DR: N-Acetyl-3,5-diiodo-L-tyrosine (CAS 1027-28-7) is a chemical compound with molecular formula C11H11I2NO4 and molecular weight 474.87775 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-acetamido-3-(4-hydroxy-3,5-diiodophenyl)propanoic acid
Also Known As: N-Acetyl-3,5-diiodo-L-tyrosine, n-acetyl-3,5-diiodotyrosine, L-Tyrosine, N-acetyl-3,5-diiodo-, N-acetyl-3-5-diiodo-L-tyrosine, 3,5-Diiodo-N-Acetyl-L-Tyrodine
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C11H11I2NO4 |
| Molecular Weight | 474.87775 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 86.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 474.87775 Da |
| Heavy Atoms | 18 |
| Complexity | 314.0 |
| SMILES | CC(=O)NC(CC1=CC(=C(C(=C1)I)O)I)C(=O)O |
| InChIKey | CDXURJOCZAIXFK-UHFFFAOYSA-N |
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Acetyl-3,5-diiodo-L-tyrosine. The TPSA of 86.6 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Acetyl-3,5-diiodo-L-tyrosine. Following Lipinski's Rule of Five, N-Acetyl-3,5-diiodo-L-tyrosine has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N-Acetyl-3,5-diiodo-L-tyrosine is 1027-28-7.
The molecular formula of N-Acetyl-3,5-diiodo-L-tyrosine is C11H11I2NO4.
The molecular weight of N-Acetyl-3,5-diiodo-L-tyrosine is 474.87775 g/mol.
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