TL;DR: N-Boc-L-cysteine ethyl ester (CAS 118143-52-5) is a chemical compound with molecular formula C10H19NO4S and molecular weight 249.10349 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl (2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-sulfanylpropanoate
Also Known As: N-Boc-L-cysteine ethyl ester, N-t-butoxycarbonyl-l-cysteine ethyl ester, ethyl (2R)-2-{[(tert-butoxy)carbonyl]amino}-3-sulfanylpropanoate, N-tert-Butoxycarbonyl-L-cysteine ethyl ester, J1.992.736I
| Molecular Formula | C10H19NO4S |
| Molecular Weight | 249.10349 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 65.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 249.10349 Da |
| Heavy Atoms | 16 |
| Complexity | 250.0 |
| SMILES | CCOC(=O)[C@H](CS)NC(=O)OC(C)(C)C |
| InChIKey | ZJZLASCAYWETRX-ZETCQYMHSA-N |
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Boc-L-cysteine ethyl ester. The TPSA of 65.6 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Boc-L-cysteine ethyl ester. Following Lipinski's Rule of Five, N-Boc-L-cysteine ethyl ester 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 N-Boc-L-cysteine ethyl ester is 118143-52-5.
The molecular formula of N-Boc-L-cysteine ethyl ester is C10H19NO4S.
The molecular weight of N-Boc-L-cysteine ethyl ester is 249.10349 g/mol.
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