TL;DR: 1,2-Cyclohexanediamine, platinum complex, trans- (CAS 112295-51-9) is a chemical compound with molecular formula C12H20N2O7Pt and molecular weight 499.09186 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
cyclohexane-1,2-diamine;hydron;2-hydroxypropane-1,2,3-tricarboxylate;platinum(2+)
Also Known As: 1,2-Cyclohexanediamine, platinum complex, trans-, 1,2,3-Propanetricarboxylic acid, 2-hydroxy-, platinum complex, Platinate(1-), (1,2-cyclohexanediamine-N,N')(2-hydroxy-1,2,3-propanetricarboxylato(3-)-01,03)-, hydrogen, (SP-4-2-(trans))-, cyclohexane-1,2-diamine; hydron; 2-hydroxypropane-1,2,3-tricarboxylate; platinum(2+)
| Molecular Formula | C12H20N2O7Pt |
| Molecular Weight | 499.09186 g/mol |
| XLogP | -4.9276 |
| Topological Polar Surface Area (TPSA) | 193.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 2 |
| Exact Mass | 499.09186 Da |
| Heavy Atoms | 22 |
| Complexity | 274.0 |
| SMILES | [H+].C1CCC(C(C1)N)N.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.[Pt+2] |
| InChIKey | XHPOYOVFZLSTHT-UHFFFAOYSA-L |
The XLogP value of -4.9276 indicates that 1,2-Cyclohexanediamine, platinum complex, trans- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 193.0 Ų indicates high polarity, suggesting 1,2-Cyclohexanediamine, platinum complex, trans- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1,2-Cyclohexanediamine, platinum complex, trans- has 4 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1,2-Cyclohexanediamine, platinum complex, trans- is 112295-51-9.
The molecular formula of 1,2-Cyclohexanediamine, platinum complex, trans- is C12H20N2O7Pt.
The molecular weight of 1,2-Cyclohexanediamine, platinum complex, trans- is 499.09186 g/mol.
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