TL;DR: N-[(3-methoxyphenyl)carbamoyl]-D-phenylalanine (CAS 1173680-60-8) is a chemical compound with molecular formula C17H18N2O4 and molecular weight 314.12665 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2R)-2-[(3-methoxyphenyl)carbamoylamino]-3-phenylpropanoic acid
Also Known As: N-[(3-methoxyphenyl)carbamoyl]-D-phenylalanine, (R)-2-(3-(3-methoxyphenyl)ureido)-3-phenylpropanoic acid, (2R)-2-[(3-methoxyphenyl)carbamoylamino]-3-phenylpropanoic acid
| Molecular Formula | C17H18N2O4 |
| Molecular Weight | 314.12665 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 87.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 314.12665 Da |
| Heavy Atoms | 23 |
| Complexity | 396.0 |
| SMILES | COC1=CC=CC(=C1)NC(=O)N[C@H](CC2=CC=CC=C2)C(=O)O |
| InChIKey | KGFAURXICLHXSM-OAHLLOKOSA-N |
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(3-methoxyphenyl)carbamoyl]-D-phenylalanine. The TPSA of 87.7 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(3-methoxyphenyl)carbamoyl]-D-phenylalanine. Following Lipinski's Rule of Five, N-[(3-methoxyphenyl)carbamoyl]-D-phenylalanine has 3 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-methoxyphenyl)carbamoyl]-D-phenylalanine is 1173680-60-8.
The molecular formula of N-[(3-methoxyphenyl)carbamoyl]-D-phenylalanine is C17H18N2O4.
The molecular weight of N-[(3-methoxyphenyl)carbamoyl]-D-phenylalanine is 314.12665 g/mol.
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