TL;DR: 2-[(2-carboxycyclopropanecarbonyl)amino]benzoic Acid (CAS 1024114-61-1) is a chemical compound with molecular formula C12H11NO5 and molecular weight 249.06372 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(2-carboxycyclopropanecarbonyl)amino]benzoic acid
Also Known As: 2-(2-carboxycyclopropaneamido)benzoic acid, 2-[(2-carboxycyclopropanecarbonyl)amino]benzoic Acid, 2-(2-carboxycyclopropaneamido)benzoicacid, 2-((2-CARBOXYCYCLOPROPYL)CARBONYLAMINO)BENZOIC ACID, 2-{[(2-carboxycyclopropyl)carbonyl]amino}benzenecarboxylic acid
| Molecular Formula | C12H11NO5 |
| Molecular Weight | 249.06372 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 104.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 249.06372 Da |
| Heavy Atoms | 18 |
| Complexity | 381.0 |
| SMILES | C1C(C1C(=O)O)C(=O)NC2=CC=CC=C2C(=O)O |
| InChIKey | FMBZACSQAXLFGC-UHFFFAOYSA-N |
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(2-carboxycyclopropanecarbonyl)amino]benzoic Acid. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(2-carboxycyclopropanecarbonyl)amino]benzoic Acid. Following Lipinski's Rule of Five, 2-[(2-carboxycyclopropanecarbonyl)amino]benzoic Acid has 3 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 2-[(2-carboxycyclopropanecarbonyl)amino]benzoic Acid is 1024114-61-1.
The molecular formula of 2-[(2-carboxycyclopropanecarbonyl)amino]benzoic Acid is C12H11NO5.
The molecular weight of 2-[(2-carboxycyclopropanecarbonyl)amino]benzoic Acid is 249.06372 g/mol.
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