TL;DR: 2-[(3,4-Dimethoxyphenyl)amino]-2-oxoethyl (4-methylphenyl)acetate (CAS 1638707-58-0) is a chemical compound with molecular formula C19H21NO5 and molecular weight 343.14197 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[2-(3,4-dimethoxyanilino)-2-oxoethyl] 2-(4-methylphenyl)acetate
Also Known As: [2-(3,4-dimethoxyanilino)-2-oxoethyl] 2-(4-methylphenyl)acetate|2-[(3,4-dimethoxyphenyl)amino]-2-oxoethyl (4-methylphenyl)acetate|F6609-3405|[(3,4-DIMETHOXYPHENYL)CARBAMOYL]METHYL 2-(4-METHYLPHENYL)ACETATE|2-((3,4-dimethoxyphenyl)amino)-2-oxoethyl 2-(p-tolyl)acetate|STL352774
| Molecular Formula | C19H21NO5 |
| Molecular Weight | 343.14197 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 73.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 343.14197 Da |
| Heavy Atoms | 25 |
| Complexity | 434.0 |
| SMILES | CC1=CC=C(C=C1)CC(=O)OCC(=O)NC2=CC(=C(C=C2)OC)OC |
| InChIKey | RJJKJVNHLVSYQQ-UHFFFAOYSA-N |
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(3,4-Dimethoxyphenyl)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-Dimethoxyphenyl)amino]-2-oxoethyl (4-methylphenyl)acetate. Following Lipinski's Rule of Five, 2-[(3,4-Dimethoxyphenyl)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-Dimethoxyphenyl)amino]-2-oxoethyl (4-methylphenyl)acetate is 1638707-58-0.
The molecular formula of 2-[(3,4-Dimethoxyphenyl)amino]-2-oxoethyl (4-methylphenyl)acetate is C19H21NO5.
The molecular weight of 2-[(3,4-Dimethoxyphenyl)amino]-2-oxoethyl (4-methylphenyl)acetate is 343.14197 g/mol.
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