TL;DR: (4-(2-Methoxyphenyl)-1-piperazinyl)(3,4,5-trimethoxyphenyl)methanone (CAS 17766-68-6) is a chemical compound with molecular formula C21H26N2O5 and molecular weight 386.18417 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[4-(2-methoxyphenyl)piperazin-1-yl]-(3,4,5-trimethoxyphenyl)methanone
Also Known As: 4-(o-Methoxyphenyl)piperazinyl 3,4,5-trimethoxyphenyl ketone, 1-(2-methoxyphenyl)-4-(3,4,5-trimethoxybenzoyl)piperazine, 5-23-02-00004 (Beilstein Handbook Reference), KETONE, 4-(o-METHOXYPHENYL)PIPERAZINYL 3,4,5-TRIMETHOXYPHENYL, 1-(o-Methoxyphenyl)-4-(3,4,5-trimethoxybenzoyl)piperazine
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C21H26N2O5 |
| Molecular Weight | 386.18417 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 60.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 386.18417 Da |
| Heavy Atoms | 28 |
| Complexity | 483.0 |
| SMILES | COC1=CC=CC=C1N2CCN(CC2)C(=O)C3=CC(=C(C(=C3)OC)OC)OC |
| InChIKey | VZXZRWMCGPZELL-UHFFFAOYSA-N |
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4-(2-Methoxyphenyl)-1-piperazinyl)(3,4,5-trimethoxyphenyl)methanone. The TPSA of 60.5 Ų falls within the moderate polarity range, balancing permeability and solubility for (4-(2-Methoxyphenyl)-1-piperazinyl)(3,4,5-trimethoxyphenyl)methanone. Following Lipinski's Rule of Five, (4-(2-Methoxyphenyl)-1-piperazinyl)(3,4,5-trimethoxyphenyl)methanone has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (4-(2-Methoxyphenyl)-1-piperazinyl)(3,4,5-trimethoxyphenyl)methanone is 17766-68-6.
The molecular formula of (4-(2-Methoxyphenyl)-1-piperazinyl)(3,4,5-trimethoxyphenyl)methanone is C21H26N2O5.
The molecular weight of (4-(2-Methoxyphenyl)-1-piperazinyl)(3,4,5-trimethoxyphenyl)methanone is 386.18417 g/mol.
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