TL;DR: 1-(thiophen-2-ylmethyl)azetidine-2-carboxylic Acid (CAS 1042440-43-6) is a chemical compound with molecular formula C9H11NO2S and molecular weight 197.05106 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(thiophen-2-ylmethyl)azetidine-2-carboxylic acid
Also Known As: 1-(thiophen-2-ylmethyl)azetidine-2-carboxylic Acid, 1-[(thiophen-2-yl)methyl]azetidine-2-carboxylic acid, 1-THIOPHEN-2-YLMETHYL-AZETIDINE-2-CARBOXYLIC ACID
| Molecular Formula | C9H11NO2S |
| Molecular Weight | 197.05106 g/mol |
| XLogP | -1.0 |
| Topological Polar Surface Area (TPSA) | 68.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 197.05106 Da |
| Heavy Atoms | 13 |
| Complexity | 210.0 |
| SMILES | C1CN(C1C(=O)O)CC2=CC=CS2 |
| InChIKey | XVKRXQQBVFPBOB-UHFFFAOYSA-N |
The XLogP value of -1.0 indicates that 1-(thiophen-2-ylmethyl)azetidine-2-carboxylic Acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 68.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(thiophen-2-ylmethyl)azetidine-2-carboxylic Acid. Following Lipinski's Rule of Five, 1-(thiophen-2-ylmethyl)azetidine-2-carboxylic Acid has 1 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 1-(thiophen-2-ylmethyl)azetidine-2-carboxylic Acid is 1042440-43-6.
The molecular formula of 1-(thiophen-2-ylmethyl)azetidine-2-carboxylic Acid is C9H11NO2S.
The molecular weight of 1-(thiophen-2-ylmethyl)azetidine-2-carboxylic Acid is 197.05106 g/mol.
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