TL;DR: Iodohippuric acid I-125 (CAS 58861-30-6) is a chemical compound with molecular formula C9H8INO3 and molecular weight 302.95505 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(2-(125I)iodobenzoyl)amino]acetic acid
Also Known As: Iodohippuric acid I-125, O-Iodohippuric acid, Hippuran I125, Hippuran-125I, iodohippurate sodium I125
| Molecular Formula | C9H8INO3 |
| Molecular Weight | 302.95505 g/mol |
| XLogP | 1.0 |
| Topological Polar Surface Area (TPSA) | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 302.95505 Da |
| Heavy Atoms | 14 |
| Complexity | 232.0 |
| SMILES | C1=CC=C(C(=C1)C(=O)NCC(=O)O)[125I] |
| InChIKey | CORFWQGVBFFZHF-CKWBHOIGSA-N |
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Iodohippuric acid I-125. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Iodohippuric acid I-125. Following Lipinski's Rule of Five, Iodohippuric acid I-125 has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Iodohippuric acid I-125 is 58861-30-6.
The molecular formula of Iodohippuric acid I-125 is C9H8INO3.
The molecular weight of Iodohippuric acid I-125 is 302.95505 g/mol.
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