TL;DR: Iocarmic Acid (CAS 10397-75-8) is a chemical compound with molecular formula C24H20I6N4O8 and molecular weight 1253.5549 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[[6-[3-carboxy-2,4,6-triiodo-5-(methylcarbamoyl)anilino]-6-oxohexanoyl]amino]-2,4,6-triiodo-5-(methylcarbamoyl)benzoic acid
Also Known As: Iocarmic acid, Acido iocarmico, Acide iocarmique, Iocarmate, Mielotrast
Top 5 of 10 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C24H20I6N4O8 |
| Molecular Weight | 1253.5549 g/mol |
| XLogP | 4.1 |
| Topological Polar Surface Area (TPSA) | 191.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 11 |
| Exact Mass | 1253.5549 Da |
| Heavy Atoms | 42 |
| Complexity | 976.0 |
| SMILES | CNC(=O)C1=C(C(=C(C(=C1I)NC(=O)CCCCC(=O)NC2=C(C(=C(C(=C2I)C(=O)O)I)C(=O)NC)I)I)C(=O)O)I |
| InChIKey | SMQYOVYWPWASGU-UHFFFAOYSA-N |
The XLogP value of 4.1 indicates that Iocarmic Acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 191.0 Ų indicates high polarity, suggesting Iocarmic Acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Iocarmic Acid has 6 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Iocarmic Acid is 10397-75-8.
The molecular formula of Iocarmic Acid is C24H20I6N4O8.
The molecular weight of Iocarmic Acid is 1253.5549 g/mol.
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