TL;DR: [4-(2,3-dimethylphenyl)piperazin-1-yl](1H-indol-2-yl)methanone (CAS 1181935-04-5) is a chemical compound with molecular formula C21H23N3O and molecular weight 333.1841 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[4-(2,3-dimethylphenyl)piperazin-1-yl]-(1H-indol-2-yl)methanone
Also Known As: [4-(2,3-dimethylphenyl)piperazin-1-yl](1H-indol-2-yl)methanone|[4-(2,3-dimethylphenyl)piperazin-1-yl]-(1H-indol-2-yl)methanone|STL028352
| Molecular Formula | C21H23N3O |
| Molecular Weight | 333.1841 g/mol |
| XLogP | 4.2 |
| Topological Polar Surface Area (TPSA) | 39.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 333.1841 Da |
| Heavy Atoms | 25 |
| Complexity | 474.0 |
| SMILES | CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C3=CC4=CC=CC=C4N3)C |
| InChIKey | QYFMZUWSIVURRU-UHFFFAOYSA-N |
The XLogP value of 4.2 indicates that [4-(2,3-dimethylphenyl)piperazin-1-yl](1H-indol-2-yl)methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.3 Ų, [4-(2,3-dimethylphenyl)piperazin-1-yl](1H-indol-2-yl)methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [4-(2,3-dimethylphenyl)piperazin-1-yl](1H-indol-2-yl)methanone has 1 hydrogen bond donor(s) and 2 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](1H-indol-2-yl)methanone is 1181935-04-5.
The molecular formula of [4-(2,3-dimethylphenyl)piperazin-1-yl](1H-indol-2-yl)methanone is C21H23N3O.
The molecular weight of [4-(2,3-dimethylphenyl)piperazin-1-yl](1H-indol-2-yl)methanone is 333.1841 g/mol.
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