TL;DR: (R)-2-((2-methylbenzofuro[3,2-d]pyrimidin-4-yl)amino)propanoic acid (CAS 1212257-65-2) is a chemical compound with molecular formula C14H13N3O3 and molecular weight 271.0957 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2R)-2-[(2-methyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)amino]propanoic acid
Also Known As: (2R)-2-[(2-methyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)amino]propanoic acid, (R)-2-((2-methylbenzofuro[3,2-d]pyrimidin-4-yl)amino)propanoic acid
| Molecular Formula | C14H13N3O3 |
| Molecular Weight | 271.0957 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 88.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 271.0957 Da |
| Heavy Atoms | 20 |
| Complexity | 379.0 |
| SMILES | CC1=NC2=C(C(=N1)N[C@H](C)C(=O)O)OC3=CC=CC=C32 |
| InChIKey | IWVUSUNIFRXFTI-SSDOTTSWSA-N |
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (R)-2-((2-methylbenzofuro[3,2-d]pyrimidin-4-yl)amino)propanoic acid. The TPSA of 88.3 Ų falls within the moderate polarity range, balancing permeability and solubility for (R)-2-((2-methylbenzofuro[3,2-d]pyrimidin-4-yl)amino)propanoic acid. Following Lipinski's Rule of Five, (R)-2-((2-methylbenzofuro[3,2-d]pyrimidin-4-yl)amino)propanoic acid has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (R)-2-((2-methylbenzofuro[3,2-d]pyrimidin-4-yl)amino)propanoic acid is 1212257-65-2.
The molecular formula of (R)-2-((2-methylbenzofuro[3,2-d]pyrimidin-4-yl)amino)propanoic acid is C14H13N3O3.
The molecular weight of (R)-2-((2-methylbenzofuro[3,2-d]pyrimidin-4-yl)amino)propanoic acid is 271.0957 g/mol.
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