TL;DR: (1S)-1-[4-(Methanesulfonyl)phenyl]-N-(2-methoxyethyl)ethan-1-amine (CAS 1228570-32-8) is a chemical compound with molecular formula C12H19NO3S and molecular weight 257.10855 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1S)-N-(2-methoxyethyl)-1-(4-methylsulfonylphenyl)ethanamine
Also Known As: Peakdale1_000352, (1S)-1-[4-(Methanesulfonyl)phenyl]-N-(2-methoxyethyl)ethan-1-amine, (alphaS)-N-(2-Methoxyethyl)-alpha-methyl-4-(methylsulfonyl)benzenemethanamine, (I+/-S)-N-(2-Methoxyethyl)-I+/--methyl-4-(methylsulfonyl)benzenemethanamine
| Molecular Formula | C12H19NO3S |
| Molecular Weight | 257.10855 g/mol |
| XLogP | 0.8 |
| Topological Polar Surface Area (TPSA) | 63.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 257.10855 Da |
| Heavy Atoms | 17 |
| Complexity | 302.0 |
| SMILES | C[C@@H](C1=CC=C(C=C1)S(=O)(=O)C)NCCOC |
| InChIKey | PXCLVBLJRPLSEC-JTQLQIEISA-N |
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1S)-1-[4-(Methanesulfonyl)phenyl]-N-(2-methoxyethyl)ethan-1-amine. The TPSA of 63.8 Ų falls within the moderate polarity range, balancing permeability and solubility for (1S)-1-[4-(Methanesulfonyl)phenyl]-N-(2-methoxyethyl)ethan-1-amine. Following Lipinski's Rule of Five, (1S)-1-[4-(Methanesulfonyl)phenyl]-N-(2-methoxyethyl)ethan-1-amine has 1 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 (1S)-1-[4-(Methanesulfonyl)phenyl]-N-(2-methoxyethyl)ethan-1-amine is 1228570-32-8.
The molecular formula of (1S)-1-[4-(Methanesulfonyl)phenyl]-N-(2-methoxyethyl)ethan-1-amine is C12H19NO3S.
The molecular weight of (1S)-1-[4-(Methanesulfonyl)phenyl]-N-(2-methoxyethyl)ethan-1-amine is 257.10855 g/mol.
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