TL;DR: (R)-2-((2-methylbenzofuro[3,2-d]pyrimidin-4-yl)amino)butanoic acid (CAS 1212111-52-8) is a chemical compound with molecular formula C15H15N3O3 and molecular weight 285.11133 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]butanoic acid
Also Known As: (2R)-2-[(2-methyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)amino]butanoic acid, (R)-2-((2-methylbenzofuro[3,2-d]pyrimidin-4-yl)amino)butanoic acid
| Molecular Formula | C15H15N3O3 |
| Molecular Weight | 285.11133 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 88.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 285.11133 Da |
| Heavy Atoms | 21 |
| Complexity | 392.0 |
| SMILES | CC[C@H](C(=O)O)NC1=NC(=NC2=C1OC3=CC=CC=C32)C |
| InChIKey | MKTPCZLNAGRLRD-SNVBAGLBSA-N |
The XLogP value of 3.3 indicates that (R)-2-((2-methylbenzofuro[3,2-d]pyrimidin-4-yl)amino)butanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. 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)butanoic acid. Following Lipinski's Rule of Five, (R)-2-((2-methylbenzofuro[3,2-d]pyrimidin-4-yl)amino)butanoic 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)butanoic acid is 1212111-52-8.
The molecular formula of (R)-2-((2-methylbenzofuro[3,2-d]pyrimidin-4-yl)amino)butanoic acid is C15H15N3O3.
The molecular weight of (R)-2-((2-methylbenzofuro[3,2-d]pyrimidin-4-yl)amino)butanoic acid is 285.11133 g/mol.
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