TL;DR: 1-((1H-Indol-3-yl)methyl)-5-oxopyrrolidine-2-carboxylic acid (CAS 1424839-66-6) is a chemical compound with molecular formula C14H14N2O3 and molecular weight 258.10043 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(1H-indol-3-ylmethyl)-5-oxopyrrolidine-2-carboxylic acid
Also Known As: 1-(1H-indol-3-ylmethyl)-5-oxoproline, 1-((1H-Indol-3-yl)methyl)-5-oxopyrrolidine-2-carboxylic acid, 1-(1H-indol-3-ylmethyl)-5-oxo-pyrrolidine-2-carboxylic acid, 1-[(1H-indol-3-yl)methyl]-5-oxopyrrolidine-2-carboxylic acid, 1-((1H-Indol-3-yl)methyl)-5-oxopyrrolidine-2-carboxylicacid
| Molecular Formula | C14H14N2O3 |
| Molecular Weight | 258.10043 g/mol |
| XLogP | 1.0 |
| Topological Polar Surface Area (TPSA) | 73.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 258.10043 Da |
| Heavy Atoms | 19 |
| Complexity | 385.0 |
| SMILES | C1CC(=O)N(C1C(=O)O)CC2=CNC3=CC=CC=C32 |
| InChIKey | POFGGCBPVCNVHO-UHFFFAOYSA-N |
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-((1H-Indol-3-yl)methyl)-5-oxopyrrolidine-2-carboxylic acid. The TPSA of 73.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-((1H-Indol-3-yl)methyl)-5-oxopyrrolidine-2-carboxylic acid. Following Lipinski's Rule of Five, 1-((1H-Indol-3-yl)methyl)-5-oxopyrrolidine-2-carboxylic acid has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-((1H-Indol-3-yl)methyl)-5-oxopyrrolidine-2-carboxylic acid is 1424839-66-6.
The molecular formula of 1-((1H-Indol-3-yl)methyl)-5-oxopyrrolidine-2-carboxylic acid is C14H14N2O3.
The molecular weight of 1-((1H-Indol-3-yl)methyl)-5-oxopyrrolidine-2-carboxylic acid is 258.10043 g/mol.
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