TL;DR: 2-Methyl-3-phenyl-1-tosylaziridine (CAS 137595-21-2) is a chemical compound with molecular formula C16H17NO2S and molecular weight 287.098 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-methyl-1-(4-methylphenyl)sulfonyl-3-phenylaziridine
Also Known As: 1-Tosyl-2-methyl-3-phenylaziridine, 2-methyl-3-phenyl-1-tosylaziridine, 1-Tosyl-2-phenyl-3-methylaziridine, 2-Phenyl-3-methyl-1-tosylaziridine, 1-(p-Tolylsulfonyl)-2-phenyl-3-methylaziridine
| Molecular Formula | C16H17NO2S |
| Molecular Weight | 287.098 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 45.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 287.098 Da |
| Heavy Atoms | 20 |
| Complexity | 428.0 |
| SMILES | CC1C(N1S(=O)(=O)C2=CC=C(C=C2)C)C3=CC=CC=C3 |
| InChIKey | VFDVJMZURMPFOQ-UHFFFAOYSA-N |
The XLogP value of 3.2 indicates that 2-Methyl-3-phenyl-1-tosylaziridine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.5 Ų, 2-Methyl-3-phenyl-1-tosylaziridine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methyl-3-phenyl-1-tosylaziridine has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-Methyl-3-phenyl-1-tosylaziridine is 137595-21-2.
The molecular formula of 2-Methyl-3-phenyl-1-tosylaziridine is C16H17NO2S.
The molecular weight of 2-Methyl-3-phenyl-1-tosylaziridine is 287.098 g/mol.
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