TL;DR: (2R)-2-(carbamoylamino)-3-(3-fluorophenyl)propanoic acid (CAS 403500-27-6) is a chemical compound with molecular formula C10H11FN2O3 and molecular weight 226.07536 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2R)-2-(carbamoylamino)-3-(3-fluorophenyl)propanoic acid
Also Known As: 3-(3-fluorophenyl)-2-ureidopropanoic acid, (2R)-2-(carbamoylamino)-3-(3-fluorophenyl)propanoic Acid
| Molecular Formula | C10H11FN2O3 |
| Molecular Weight | 226.07536 g/mol |
| XLogP | 0.7 |
| Topological Polar Surface Area (TPSA) | 92.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 226.07536 Da |
| Heavy Atoms | 16 |
| Complexity | 273.0 |
| SMILES | C1=CC(=CC(=C1)F)C[C@H](C(=O)O)NC(=O)N |
| InChIKey | QDGFBTSSBMSHKT-MRVPVSSYSA-N |
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2R)-2-(carbamoylamino)-3-(3-fluorophenyl)propanoic acid. The TPSA of 92.4 Ų falls within the moderate polarity range, balancing permeability and solubility for (2R)-2-(carbamoylamino)-3-(3-fluorophenyl)propanoic acid. Following Lipinski's Rule of Five, (2R)-2-(carbamoylamino)-3-(3-fluorophenyl)propanoic acid 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 (2R)-2-(carbamoylamino)-3-(3-fluorophenyl)propanoic acid is 403500-27-6.
The molecular formula of (2R)-2-(carbamoylamino)-3-(3-fluorophenyl)propanoic acid is C10H11FN2O3.
The molecular weight of (2R)-2-(carbamoylamino)-3-(3-fluorophenyl)propanoic acid is 226.07536 g/mol.
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