TL;DR: L-Cysteine, N-acetyl-, methyl ester (CAS 1310680-36-4) is a chemical compound with molecular formula C6H11NO3S and molecular weight 177.04596 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl (2R)-2-acetamido-3-sulfanylpropanoate
Also Known As: N-Acetyl-L-cysteine methyl ester, Methyl acetyl-L-cysteinate, L-Cysteine,N-acetyl-, methyl ester, (R)-methyl 2-acetamido-3-mercaptopropanoate, N-Acetyl-L-Cys-OMe
| Molecular Formula | C6H11NO3S |
| Molecular Weight | 177.04596 g/mol |
| XLogP | 0.7 |
| Topological Polar Surface Area (TPSA) | 56.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 177.04596 Da |
| Heavy Atoms | 11 |
| Complexity | 160.0 |
| SMILES | CC(=O)N[C@@H](CS)C(=O)OC |
| InChIKey | QTKAQJWFVXPIFV-YFKPBYRVSA-N |
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for L-Cysteine, N-acetyl-, methyl ester. With a topological polar surface area (TPSA) of 56.4 Ų, L-Cysteine, N-acetyl-, methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, L-Cysteine, N-acetyl-, methyl ester has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of L-Cysteine, N-acetyl-, methyl ester is 1310680-36-4.
The molecular formula of L-Cysteine, N-acetyl-, methyl ester is C6H11NO3S.
The molecular weight of L-Cysteine, N-acetyl-, methyl ester is 177.04596 g/mol.
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