TL;DR: Carboxy-PTIO potassium salt (CAS 148819-93-6) is a chemical compound with molecular formula C14H16KN2O4 and molecular weight 315.0747 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
Also Known As: carboxy-ptio, Carboxy-PTIO potassium salt, corboxy-PTIO, Carboxy-ptio, potassium salt, potassium 4-(1-
| Molecular Formula | C14H16KN2O4 |
| Molecular Weight | 315.0747 g/mol |
| XLogP | -2.4707 |
| Topological Polar Surface Area (TPSA) | 73.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 315.0747 Da |
| Heavy Atoms | 21 |
| Complexity | 418.0 |
| SMILES | CC1(C([N+](=C(N1[O])C2=CC=C(C=C2)C(=O)[O-])[O-])(C)C)C.[K+] |
| InChIKey | VYEUQMVIGXFZQU-UHFFFAOYSA-M |
The XLogP value of -2.4707 indicates that Carboxy-PTIO potassium salt is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 73.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Carboxy-PTIO potassium salt. Following Lipinski's Rule of Five, Carboxy-PTIO potassium salt has 0 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 Carboxy-PTIO potassium salt is 148819-93-6.
The molecular formula of Carboxy-PTIO potassium salt is C14H16KN2O4.
The molecular weight of Carboxy-PTIO potassium salt is 315.0747 g/mol.
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