TL;DR: N-(2-Phenethyl)glutaramic acid (CAS 119627-14-4) is a chemical compound with molecular formula C13H17NO3 and molecular weight 235.12085 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-oxo-5-(2-phenylethylamino)pentanoic acid
Also Known As: 4-[(2-phenylethyl)carbamoyl]butanoic acid, 5-oxo-5-(2-phenylethylamino)pentanoic acid, 4-Phenethylcarbamoyl-butyric acid, 4-(Phenethylcarbamoyl)butyric acid, 4-(phenethylcarbamoyl)butanoic Acid
| Molecular Formula | C13H17NO3 |
| Molecular Weight | 235.12085 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 235.12085 Da |
| Heavy Atoms | 17 |
| Complexity | 247.0 |
| SMILES | C1=CC=C(C=C1)CCNC(=O)CCCC(=O)O |
| InChIKey | YDQWOZQRRHREID-UHFFFAOYSA-N |
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-Phenethyl)glutaramic acid. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-Phenethyl)glutaramic acid. Following Lipinski's Rule of Five, N-(2-Phenethyl)glutaramic acid 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 N-(2-Phenethyl)glutaramic acid is 119627-14-4.
The molecular formula of N-(2-Phenethyl)glutaramic acid is C13H17NO3.
The molecular weight of N-(2-Phenethyl)glutaramic acid is 235.12085 g/mol.
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