TL;DR: 1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(4-ethoxyphenyl)methyl]-1,3-diazinane-2,4,6-trione (CAS 578005-41-1) is a chemical compound with molecular formula C23H26N2O6 and molecular weight 426.17908 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(4-ethoxyphenyl)methyl]-1,3-diazinane-2,4,6-trione
Also Known As: 1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(4-ethoxyphenyl)methyl]-1,3-diazinane-2,4,6-trione, 1-(3,4-dimethoxyphenethyl)-5-(4-ethoxybenzyl)pyrimidine-2,4,6(1H,3H,5H)-trione, 3-[2-(3,4-dimethoxyphenyl)ethyl]-5-(4-ethoxybenzyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione
| Molecular Formula | C23H26N2O6 |
| Molecular Weight | 426.17908 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 94.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 426.17908 Da |
| Heavy Atoms | 31 |
| Complexity | 634.0 |
| SMILES | CCOC1=CC=C(C=C1)CC2C(=O)NC(=O)N(C2=O)CCC3=CC(=C(C=C3)OC)OC |
| InChIKey | IBRGYKGYOAKBLO-UHFFFAOYSA-N |
The XLogP value of 3.2 indicates that 1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(4-ethoxyphenyl)methyl]-1,3-diazinane-2,4,6-trione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(4-ethoxyphenyl)methyl]-1,3-diazinane-2,4,6-trione. Following Lipinski's Rule of Five, 1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(4-ethoxyphenyl)methyl]-1,3-diazinane-2,4,6-trione has 1 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 1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(4-ethoxyphenyl)methyl]-1,3-diazinane-2,4,6-trione is 578005-41-1.
The molecular formula of 1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(4-ethoxyphenyl)methyl]-1,3-diazinane-2,4,6-trione is C23H26N2O6.
The molecular weight of 1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(4-ethoxyphenyl)methyl]-1,3-diazinane-2,4,6-trione is 426.17908 g/mol.
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