TL;DR: 1-Imidazolidineacetic acid, 3-(4-methoxy-1-naphthyl)-2,4,5-trioxo-, ethyl ester (CAS 101564-81-2) is a chemical compound with molecular formula C18H16N2O6 and molecular weight 356.10083 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 2-[3-(4-methoxynaphthalen-1-yl)-2,4,5-trioxoimidazolidin-1-yl]acetate
Also Known As: NCI60_021992, 1-IMIDAZOLIDINEACETIC ACID, 3-(4-METHOXY-1-NAPHTHYL)-2,4,5-TRIOXO-, ETHYL ESTER, 1-(Carboethoxymethyl)-3-(4-methoxy-1-naphthyl)-parabanic acid, 3-(4-Methoxy-1-naphthyl)-2,4,5-trioxo-1-imidazolidineacetic acid ethyl ester, ethyl 2-[3-(4-methoxynaphthalen-1-yl)-2,4,5-trioxoimidazolidin-1-yl]acetate
| Molecular Formula | C18H16N2O6 |
| Molecular Weight | 356.10083 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 93.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 356.10083 Da |
| Heavy Atoms | 26 |
| Complexity | 606.0 |
| SMILES | CCOC(=O)CN1C(=O)C(=O)N(C1=O)C2=CC=C(C3=CC=CC=C32)OC |
| InChIKey | QLYJIGRAKDGNNG-UHFFFAOYSA-N |
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Imidazolidineacetic acid, 3-(4-methoxy-1-naphthyl)-2,4,5-trioxo-, ethyl ester. The TPSA of 93.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Imidazolidineacetic acid, 3-(4-methoxy-1-naphthyl)-2,4,5-trioxo-, ethyl ester. Following Lipinski's Rule of Five, 1-Imidazolidineacetic acid, 3-(4-methoxy-1-naphthyl)-2,4,5-trioxo-, ethyl ester 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 1-Imidazolidineacetic acid, 3-(4-methoxy-1-naphthyl)-2,4,5-trioxo-, ethyl ester is 101564-81-2.
The molecular formula of 1-Imidazolidineacetic acid, 3-(4-methoxy-1-naphthyl)-2,4,5-trioxo-, ethyl ester is C18H16N2O6.
The molecular weight of 1-Imidazolidineacetic acid, 3-(4-methoxy-1-naphthyl)-2,4,5-trioxo-, ethyl ester is 356.10083 g/mol.
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