TL;DR: 3-(3-methoxybenzoyl)-3-azabicyclo[3.1.0]hexane-2-carboxylic Acid (CAS 1009708-17-1) is a chemical compound with molecular formula C14H15NO4 and molecular weight 261.1001 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(3-methoxybenzoyl)-3-azabicyclo[3.1.0]hexane-2-carboxylic acid
Also Known As: 3-(3-methoxybenzoyl)-3-azabicyclo[3.1.0]hexane-2-carboxylic Acid, 3-Azabicyclo[3.1.0]hexane-2-carboxylic acid, 3-(3-methoxybenzoyl)-, 3-(3-methoxybenzoyl)-3-azabicyclo[3.1.0]hexane-2-carboxylicAcid, 3-(3-methoxybenzoyl)-3-azabicyclo[3.1.0]hexane-4-carboxylic acid
| Molecular Formula | C14H15NO4 |
| Molecular Weight | 261.1001 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 66.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 261.1001 Da |
| Heavy Atoms | 19 |
| Complexity | 397.0 |
| SMILES | COC1=CC=CC(=C1)C(=O)N2CC3CC3C2C(=O)O |
| InChIKey | QACJHRLGLSVZIU-UHFFFAOYSA-N |
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(3-methoxybenzoyl)-3-azabicyclo[3.1.0]hexane-2-carboxylic Acid. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(3-methoxybenzoyl)-3-azabicyclo[3.1.0]hexane-2-carboxylic Acid. Following Lipinski's Rule of Five, 3-(3-methoxybenzoyl)-3-azabicyclo[3.1.0]hexane-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 3-(3-methoxybenzoyl)-3-azabicyclo[3.1.0]hexane-2-carboxylic Acid is 1009708-17-1.
The molecular formula of 3-(3-methoxybenzoyl)-3-azabicyclo[3.1.0]hexane-2-carboxylic Acid is C14H15NO4.
The molecular weight of 3-(3-methoxybenzoyl)-3-azabicyclo[3.1.0]hexane-2-carboxylic Acid is 261.1001 g/mol.
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