TL;DR: Boc-cys(ME)-OH (CAS 1429914-24-8) is a chemical compound with molecular formula C9H17NO4S and molecular weight 235.08783 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-methylsulfanylpropanoic acid
Also Known As: BOC-CYS(ME)-OH, N-Boc-S-methyl-L-cysteine, Boc-S-methyl-L-cysteine, boccys(me)oh, Boc-S-methylcysteine
| Molecular Formula | C9H17NO4S |
| Molecular Weight | 235.08783 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 101.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 235.08783 Da |
| Heavy Atoms | 15 |
| Complexity | 237.0 |
| SMILES | CC(C)(C)OC(=O)N[C@@H](CSC)C(=O)O |
| InChIKey | WFDQTEFRLDDJAM-LURJTMIESA-N |
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Boc-cys(ME)-OH. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Boc-cys(ME)-OH. Following Lipinski's Rule of Five, Boc-cys(ME)-OH has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Boc-cys(ME)-OH is 1429914-24-8.
The molecular formula of Boc-cys(ME)-OH is C9H17NO4S.
The molecular weight of Boc-cys(ME)-OH is 235.08783 g/mol.
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