TL;DR: N-[(2-methylphenyl)carbamoyl]-L-phenylalanine (CAS 1173683-10-7) is a chemical compound with molecular formula C17H18N2O3 and molecular weight 298.13174 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-2-[(2-methylphenyl)carbamoylamino]-3-phenylpropanoic acid
Also Known As: N-[(2-methylphenyl)carbamoyl]-L-phenylalanine, (S)-3-phenyl-2-(3-(o-tolyl)ureido)propanoic acid, 2-[(2-methylphenyl)carbamoylamino]-3-phenyl-propanoic Acid, (2S)-2-[(2-methylphenyl)carbamoylamino]-3-phenylpropanoic acid
| Molecular Formula | C17H18N2O3 |
| Molecular Weight | 298.13174 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 78.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 298.13174 Da |
| Heavy Atoms | 22 |
| Complexity | 380.0 |
| SMILES | CC1=CC=CC=C1NC(=O)N[C@@H](CC2=CC=CC=C2)C(=O)O |
| InChIKey | RREJZAZXOJXIDV-HNNXBMFYSA-N |
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(2-methylphenyl)carbamoyl]-L-phenylalanine. The TPSA of 78.4 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(2-methylphenyl)carbamoyl]-L-phenylalanine. Following Lipinski's Rule of Five, N-[(2-methylphenyl)carbamoyl]-L-phenylalanine has 3 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-methylphenyl)carbamoyl]-L-phenylalanine is 1173683-10-7.
The molecular formula of N-[(2-methylphenyl)carbamoyl]-L-phenylalanine is C17H18N2O3.
The molecular weight of N-[(2-methylphenyl)carbamoyl]-L-phenylalanine is 298.13174 g/mol.
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