TL;DR: RefChem:898677 (CAS 19332-78-6) is a chemical compound with molecular formula C14H18CuN2O8-2 and molecular weight 405.03592 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
copper 2-[[(1R,2R)-2-[bis(carboxylatomethyl)amino]cyclohexyl]-(carboxylatomethyl)amino]acetate
Also Known As: Cuprate(2-), ((rel-N,N'-(1R,2R)-1,2-cyclohexanediylbis(N-((carboxy-kappaO)methyl)glycinato-kappaN,kappaO))(4-))-, (OC-6-21)-, Trans-[[N,N'-cyclohexane-1,2-diylbis[N-(carboxymethyl)glycinato]](4-)-N,N',O,O',ON,ON']cuprate(2-), Cuprate(2-), [[rel-N,N'-(1R,2R)-1,2-cyclohexanediylbis[N-[(carboxy-.kappa.O)methyl]glycinato-.kappa.N,.kappa.O]](4-)]-, (OC-6-21)-, Cuprate(2-), [[N,N'-1,2-cyclohexanediylbis[ N-(carboxymethyl)glycinato]](4-)-N,N',O,O',O#N ,O#N#']-, [OC-6-21-(trans)]-, trans-((N,N'-Cyclohexane-1,2-diylbis(N-(carboxymethyl)glycinato))(4-)-N,N',O,O',ON,ON')cuprate(2-)
| Molecular Formula | C14H18CuN2O8-2 |
| Molecular Weight | 405.03592 g/mol |
| XLogP | -6.1 |
| Topological Polar Surface Area (TPSA) | 167.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 6 |
| Exact Mass | 405.03592 Da |
| Heavy Atoms | 25 |
| Complexity | 397.0 |
| SMILES | C1CC[C@H]([C@@H](C1)N(CC(=O)[O-])CC(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].[Cu+2] |
| InChIKey | PWAQDUQNXWQWFC-DHTOPLTISA-J |
The XLogP value of -6.1 indicates that RefChem:898677 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 167.0 Ų indicates high polarity, suggesting RefChem:898677 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:898677 has 0 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of RefChem:898677 is 19332-78-6.
The molecular formula of RefChem:898677 is C14H18CuN2O8-2.
The molecular weight of RefChem:898677 is 405.03592 g/mol.
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