TL;DR: (4-(2,3-dimethylphenyl)piperazin-1-yl)(4,5,6-trimethoxy-1H-indol-2-yl)methanone (CAS 898914-52-8) is a chemical compound with molecular formula C24H29N3O4 and molecular weight 423.21582 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[4-(2,3-dimethylphenyl)piperazin-1-yl]-(4,5,6-trimethoxy-1H-indol-2-yl)methanone
Also Known As: (4-(2,3-dimethylphenyl)piperazin-1-yl)(4,5,6-trimethoxy-1H-indol-2-yl)methanone, [4-(2,3-dimethylphenyl)piperazin-1-yl](4,5,6-trimethoxy-1H-indol-2-yl)methanone, [4-(2,3-dimethylphenyl)piperazin-1-yl]-(4,5,6-trimethoxy-1H-indol-2-yl)methanone
| Molecular Formula | C24H29N3O4 |
| Molecular Weight | 423.21582 g/mol |
| XLogP | 4.1 |
| Topological Polar Surface Area (TPSA) | 67.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 423.21582 Da |
| Heavy Atoms | 31 |
| Complexity | 612.0 |
| SMILES | CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C3=CC4=C(C(=C(C=C4N3)OC)OC)OC)C |
| InChIKey | UZQPYLTUHMJIMT-UHFFFAOYSA-N |
The XLogP value of 4.1 indicates that (4-(2,3-dimethylphenyl)piperazin-1-yl)(4,5,6-trimethoxy-1H-indol-2-yl)methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (4-(2,3-dimethylphenyl)piperazin-1-yl)(4,5,6-trimethoxy-1H-indol-2-yl)methanone. Following Lipinski's Rule of Five, (4-(2,3-dimethylphenyl)piperazin-1-yl)(4,5,6-trimethoxy-1H-indol-2-yl)methanone has 1 hydrogen bond donor(s) and 5 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)(4,5,6-trimethoxy-1H-indol-2-yl)methanone is 898914-52-8.
The molecular formula of (4-(2,3-dimethylphenyl)piperazin-1-yl)(4,5,6-trimethoxy-1H-indol-2-yl)methanone is C24H29N3O4.
The molecular weight of (4-(2,3-dimethylphenyl)piperazin-1-yl)(4,5,6-trimethoxy-1H-indol-2-yl)methanone is 423.21582 g/mol.
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