TL;DR: [4-(2,3-Dimethylphenyl)piperazin-1-yl]-(2-methylsulfanylphenyl)methanone (CAS 915904-57-3) is a chemical compound with molecular formula C20H24N2OS and molecular weight 340.16095 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[4-(2,3-dimethylphenyl)piperazin-1-yl]-(2-methylsulfanylphenyl)methanone
Also Known As: [4-(2,3-dimethylphenyl)piperazin-1-yl]-(2-methylsulfanylphenyl)methanone|[4-(2,3-dimethylphenyl)piperazin-1-yl][2-(methylsulfanyl)phenyl]methanone|STL088989
| Molecular Formula | C20H24N2OS |
| Molecular Weight | 340.16095 g/mol |
| XLogP | 4.2 |
| Topological Polar Surface Area (TPSA) | 48.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 340.16095 Da |
| Heavy Atoms | 24 |
| Complexity | 422.0 |
| SMILES | CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C3=CC=CC=C3SC)C |
| InChIKey | JIZOWZBORIRWFZ-UHFFFAOYSA-N |
The XLogP value of 4.2 indicates that [4-(2,3-Dimethylphenyl)piperazin-1-yl]-(2-methylsulfanylphenyl)methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.9 Ų, [4-(2,3-Dimethylphenyl)piperazin-1-yl]-(2-methylsulfanylphenyl)methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [4-(2,3-Dimethylphenyl)piperazin-1-yl]-(2-methylsulfanylphenyl)methanone 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 [4-(2,3-Dimethylphenyl)piperazin-1-yl]-(2-methylsulfanylphenyl)methanone is 915904-57-3.
The molecular formula of [4-(2,3-Dimethylphenyl)piperazin-1-yl]-(2-methylsulfanylphenyl)methanone is C20H24N2OS.
The molecular weight of [4-(2,3-Dimethylphenyl)piperazin-1-yl]-(2-methylsulfanylphenyl)methanone is 340.16095 g/mol.
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