TL;DR: N2-Butyl-N4-(2,4-dimethoxyphenyl)-L-asparagine (CAS 1025764-55-9) is a chemical compound with molecular formula C16H24N2O5 and molecular weight 324.16852 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-2-(butylamino)-4-(2,4-dimethoxyanilino)-4-oxobutanoic acid
Also Known As: N2-Butyl-N4-(2,4-dimethoxyphenyl)-L-asparagine, 2-butylamino-3-[(2,4-dimethoxyphenyl)carbamoyl]propanoic Acid, (2S)-2-(butylamino)-4-(2,4-dimethoxyanilino)-4-oxobutanoic acid
| Molecular Formula | C16H24N2O5 |
| Molecular Weight | 324.16852 g/mol |
| XLogP | 0.3 |
| Topological Polar Surface Area (TPSA) | 104.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 324.16852 Da |
| Heavy Atoms | 23 |
| Complexity | 372.0 |
| SMILES | CCCCN[C@@H](CC(=O)NC1=C(C=C(C=C1)OC)OC)C(=O)O |
| InChIKey | MJYKPNIONNVXDR-ZDUSSCGKSA-N |
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N2-Butyl-N4-(2,4-dimethoxyphenyl)-L-asparagine. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N2-Butyl-N4-(2,4-dimethoxyphenyl)-L-asparagine. Following Lipinski's Rule of Five, N2-Butyl-N4-(2,4-dimethoxyphenyl)-L-asparagine has 2 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 N2-Butyl-N4-(2,4-dimethoxyphenyl)-L-asparagine is 1025764-55-9.
The molecular formula of N2-Butyl-N4-(2,4-dimethoxyphenyl)-L-asparagine is C16H24N2O5.
The molecular weight of N2-Butyl-N4-(2,4-dimethoxyphenyl)-L-asparagine is 324.16852 g/mol.
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