TL;DR: Piperazine, 1,4-bis(3,4,5-triallyloxybenzoyl)- (CAS 63980-46-1) is a chemical compound with molecular formula C36H42N2O8 and molecular weight 630.2941 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[4-[3,4,5-tris(prop-2-enoxy)benzoyl]piperazin-1-yl]-[3,4,5-tris(prop-2-enoxy)phenyl]methanone
Also Known As: 1,4-Bis(3,4,5-triallyloxybenzoyl)piperazine, 1,4-Bis[3,4,5-tris benzoyl]piperazine, Piperazine, 1,4-bis(3,4,5-triallyloxybenzoyl)-, 5-23-01-00079 (Beilstein Handbook Reference), 1,4-Bis[3,4,5-tris(allyloxy)benzoyl]piperazine
| Molecular Formula | C36H42N2O8 |
| Molecular Weight | 630.2941 g/mol |
| XLogP | 6.0 |
| Topological Polar Surface Area (TPSA) | 96.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 20 |
| Exact Mass | 630.2941 Da |
| Heavy Atoms | 46 |
| Complexity | 901.0 |
| SMILES | C=CCOC1=CC(=CC(=C1OCC=C)OCC=C)C(=O)N2CCN(CC2)C(=O)C3=CC(=C(C(=C3)OCC=C)OCC=C)OCC=C |
| InChIKey | AZVOUNYRZMVGIH-UHFFFAOYSA-N |
The XLogP value of 6.0 indicates that Piperazine, 1,4-bis(3,4,5-triallyloxybenzoyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Piperazine, 1,4-bis(3,4,5-triallyloxybenzoyl)-. Following Lipinski's Rule of Five, Piperazine, 1,4-bis(3,4,5-triallyloxybenzoyl)- has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Piperazine, 1,4-bis(3,4,5-triallyloxybenzoyl)- is 63980-46-1.
The molecular formula of Piperazine, 1,4-bis(3,4,5-triallyloxybenzoyl)- is C36H42N2O8.
The molecular weight of Piperazine, 1,4-bis(3,4,5-triallyloxybenzoyl)- is 630.2941 g/mol.
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