TL;DR: N-(3,5-dimethylphenyl)-2-{1-[(4-methoxyphenyl)carbonyl]-3-oxodecahydroquinoxalin-2-yl}acetamide (CAS 1025062-22-9) is a chemical compound with molecular formula C26H31N3O4 and molecular weight 449.23145 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(3,5-dimethylphenyl)-2-[1-(4-methoxybenzoyl)-3-oxo-2,4,4a,5,6,7,8,8a-octahydroquinoxalin-2-yl]acetamide
Also Known As: N-(3,5-dimethylphenyl)-2-{1-[(4-methoxyphenyl)carbonyl]-3-oxodecahydroquinoxalin-2-yl}acetamide, N-(3,5-dimethylphenyl)-2-(1-(4-methoxybenzoyl)-3-oxodecahydroquinoxalin-2-yl)acetamide, N-(3,5-dimethylphenyl)-2-[1-(4-methoxybenzoyl)-3-oxo-2,4,4a,5,6,7,8,8a-octahydroquinoxalin-2-yl]acetamide, N-(3,5-DIMETHYLPHENYL)-2-[1-(4-METHOXYBENZOYL)-3-OXO-DECAHYDROQUINOXALIN-2-YL]ACETAMIDE, N-(3,5-dimethylphenyl)-2-{2-[(4-methoxyphenyl)carbonyl]-4-oxo-2,5-diazabicyclo [4.4.0]dec-3-yl}acetamide
| Molecular Formula | C26H31N3O4 |
| Molecular Weight | 449.23145 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 87.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 449.23145 Da |
| Heavy Atoms | 33 |
| Complexity | 710.0 |
| SMILES | CC1=CC(=CC(=C1)NC(=O)CC2C(=O)NC3CCCCC3N2C(=O)C4=CC=C(C=C4)OC)C |
| InChIKey | RJUCJJZVFJESCM-UHFFFAOYSA-N |
The XLogP value of 3.4 indicates that N-(3,5-dimethylphenyl)-2-{1-[(4-methoxyphenyl)carbonyl]-3-oxodecahydroquinoxalin-2-yl}acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.7 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3,5-dimethylphenyl)-2-{1-[(4-methoxyphenyl)carbonyl]-3-oxodecahydroquinoxalin-2-yl}acetamide. Following Lipinski's Rule of Five, N-(3,5-dimethylphenyl)-2-{1-[(4-methoxyphenyl)carbonyl]-3-oxodecahydroquinoxalin-2-yl}acetamide has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N-(3,5-dimethylphenyl)-2-{1-[(4-methoxyphenyl)carbonyl]-3-oxodecahydroquinoxalin-2-yl}acetamide is 1025062-22-9.
The molecular formula of N-(3,5-dimethylphenyl)-2-{1-[(4-methoxyphenyl)carbonyl]-3-oxodecahydroquinoxalin-2-yl}acetamide is C26H31N3O4.
The molecular weight of N-(3,5-dimethylphenyl)-2-{1-[(4-methoxyphenyl)carbonyl]-3-oxodecahydroquinoxalin-2-yl}acetamide is 449.23145 g/mol.
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