TL;DR: (R)-1-(2-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)acetyl)pyrrolidine-2-carboxylic acid (CAS 956047-19-1) is a chemical compound with molecular formula C15H15N3O5 and molecular weight 317.10117 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2R)-1-[2-(2,4-dioxo-1H-quinazolin-3-yl)acetyl]pyrrolidine-2-carboxylic acid
Also Known As: (R)-1-(2-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)acetyl)pyrrolidine-2-carboxylic acid, 1-[2-(2,4-dioxo-1H-quinazolin-3-yl)acetyl]pyrrolidine-2-carboxylic Acid, (2R)-1-[2-(2,4-dioxo-1H-quinazolin-3-yl)acetyl]pyrrolidine-2-carboxylic acid
| Molecular Formula | C15H15N3O5 |
| Molecular Weight | 317.10117 g/mol |
| XLogP | 0.3 |
| Topological Polar Surface Area (TPSA) | 107.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 317.10117 Da |
| Heavy Atoms | 23 |
| Complexity | 549.0 |
| SMILES | C1C[C@@H](N(C1)C(=O)CN2C(=O)C3=CC=CC=C3NC2=O)C(=O)O |
| InChIKey | AJQUINMOGWOZIL-LLVKDONJSA-N |
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (R)-1-(2-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)acetyl)pyrrolidine-2-carboxylic acid. The TPSA of 107.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (R)-1-(2-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)acetyl)pyrrolidine-2-carboxylic acid. Following Lipinski's Rule of Five, (R)-1-(2-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)acetyl)pyrrolidine-2-carboxylic acid has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (R)-1-(2-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)acetyl)pyrrolidine-2-carboxylic acid is 956047-19-1.
The molecular formula of (R)-1-(2-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)acetyl)pyrrolidine-2-carboxylic acid is C15H15N3O5.
The molecular weight of (R)-1-(2-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)acetyl)pyrrolidine-2-carboxylic acid is 317.10117 g/mol.
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