TL;DR: 2-[(3,4-Dimethoxybenzyl)amino]-2-oxoethyl (4-methylphenyl)acetate (CAS 1288725-08-5) is a chemical compound with molecular formula C20H23NO5 and molecular weight 357.15762 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[2-[(3,4-dimethoxyphenyl)methylamino]-2-oxoethyl] 2-(4-methylphenyl)acetate
Also Known As: 2-[(3,4-dimethoxybenzyl)amino]-2-oxoethyl (4-methylphenyl)acetate, [2-[(3,4-dimethoxyphenyl)methylamino]-2-oxoethyl] 2-(4-methylphenyl)acetate, F6609-3429, {[(3,4-DIMETHOXYPHENYL)METHYL]CARBAMOYL}METHYL 2-(4-METHYLPHENYL)ACETATE, 2-((3,4-dimethoxybenzyl)amino)-2-oxoethyl 2-(p-tolyl)acetate
| Molecular Formula | C20H23NO5 |
| Molecular Weight | 357.15762 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 73.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 357.15762 Da |
| Heavy Atoms | 26 |
| Complexity | 447.0 |
| SMILES | CC1=CC=C(C=C1)CC(=O)OCC(=O)NCC2=CC(=C(C=C2)OC)OC |
| InChIKey | HMWUPAZLDDGYRF-UHFFFAOYSA-N |
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(3,4-Dimethoxybenzyl)amino]-2-oxoethyl (4-methylphenyl)acetate. The TPSA of 73.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(3,4-Dimethoxybenzyl)amino]-2-oxoethyl (4-methylphenyl)acetate. Following Lipinski's Rule of Five, 2-[(3,4-Dimethoxybenzyl)amino]-2-oxoethyl (4-methylphenyl)acetate 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 2-[(3,4-Dimethoxybenzyl)amino]-2-oxoethyl (4-methylphenyl)acetate is 1288725-08-5.
The molecular formula of 2-[(3,4-Dimethoxybenzyl)amino]-2-oxoethyl (4-methylphenyl)acetate is C20H23NO5.
The molecular weight of 2-[(3,4-Dimethoxybenzyl)amino]-2-oxoethyl (4-methylphenyl)acetate is 357.15762 g/mol.
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