TL;DR: N4-(3,5-Dimethylphenyl)-N2,N2-dimethyl-L-asparagine (CAS 1030619-89-6) is a chemical compound with molecular formula C14H20N2O3 and molecular weight 264.1474 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-2-(dimethylamino)-4-(3,5-dimethylanilino)-4-oxobutanoic acid
Also Known As: IFLab1_006004, N4-(3,5-Dimethylphenyl)-N2,N2-dimethyl-L-asparagine, (2S)-2-(dimethylamino)-4-(3,5-dimethylanilino)-4-oxobutanoic acid
| Molecular Formula | C14H20N2O3 |
| Molecular Weight | 264.1474 g/mol |
| XLogP | 0.3 |
| Topological Polar Surface Area (TPSA) | 73.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 264.1474 Da |
| Heavy Atoms | 19 |
| Complexity | 315.0 |
| SMILES | CC1=CC(=CC(=C1)NC(=O)C[C@@H](C(=O)O)N(C)C)C |
| InChIKey | ZLNRXLWQHXRAAI-LBPRGKRZSA-N |
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N4-(3,5-Dimethylphenyl)-N2,N2-dimethyl-L-asparagine. The TPSA of 73.7 Ų falls within the moderate polarity range, balancing permeability and solubility for N4-(3,5-Dimethylphenyl)-N2,N2-dimethyl-L-asparagine. Following Lipinski's Rule of Five, N4-(3,5-Dimethylphenyl)-N2,N2-dimethyl-L-asparagine has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N4-(3,5-Dimethylphenyl)-N2,N2-dimethyl-L-asparagine is 1030619-89-6.
The molecular formula of N4-(3,5-Dimethylphenyl)-N2,N2-dimethyl-L-asparagine is C14H20N2O3.
The molecular weight of N4-(3,5-Dimethylphenyl)-N2,N2-dimethyl-L-asparagine is 264.1474 g/mol.
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