TL;DR: (H-Cys-OMe)2.2HCl (CAS 32854-09-4) is a chemical compound with molecular formula C8H18Cl2N2O4S2 and molecular weight 340.0085 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 2-amino-3-[(2-amino-3-methoxy-3-oxopropyl)disulfanyl]propanoate;dihydrochloride
Also Known As: dimethyl cystinate 2hcl, (H-Cys-OMe)2.2HCl, Dimethyl L-cystinate dihydrochloride, Dimethyl L-cystinate HCl, (H-d-cys-ome)2 2 hcl
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C8H18Cl2N2O4S2 |
| Molecular Weight | 340.0085 g/mol |
| XLogP | 0.21 |
| Topological Polar Surface Area (TPSA) | 155.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 340.0085 Da |
| Heavy Atoms | 18 |
| Complexity | 216.0 |
| SMILES | COC(=O)C(CSSCC(C(=O)OC)N)N.Cl.Cl |
| InChIKey | QKWGUPFPCRKKMQ-UHFFFAOYSA-N |
The XLogP value of 0.21 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (H-Cys-OMe)2.2HCl. The TPSA of 155.0 Ų indicates high polarity, suggesting (H-Cys-OMe)2.2HCl may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (H-Cys-OMe)2.2HCl has 4 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (H-Cys-OMe)2.2HCl is 32854-09-4.
The molecular formula of (H-Cys-OMe)2.2HCl is C8H18Cl2N2O4S2.
The molecular weight of (H-Cys-OMe)2.2HCl is 340.0085 g/mol.
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