TL;DR: Endo-3-cbz-3-azabicyclo[3.1.0]hexane-6-carboxylic acid (CAS 1417556-03-6) 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-phenylmethoxycarbonyl-3-azabicyclo[3.1.0]hexane-6-carboxylic acid
Also Known As: Endo-3-cbz-3-azabicyclo[3.1.0]hexane-6-carboxylic acid, exo-3-Cbz-3-azabicyclo[3.1.0]hexane-6-carboxylic acid, R272, endo-3-Cbz-3-azabicyclo[3.1.0]-hexane-6-carboxylic acid, 3-phenylmethoxycarbonyl-3-azabicyclo[3.1.0]hexane-6-carboxylic Acid
| Molecular Formula | C14H15NO4 |
| Molecular Weight | 261.1001 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 66.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 261.1001 Da |
| Heavy Atoms | 19 |
| Complexity | 366.0 |
| SMILES | C1C2C(C2C(=O)O)CN1C(=O)OCC3=CC=CC=C3 |
| InChIKey | ICSLZBSYUJAPNS-UHFFFAOYSA-N |
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Endo-3-cbz-3-azabicyclo[3.1.0]hexane-6-carboxylic acid. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Endo-3-cbz-3-azabicyclo[3.1.0]hexane-6-carboxylic acid. Following Lipinski's Rule of Five, Endo-3-cbz-3-azabicyclo[3.1.0]hexane-6-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 Endo-3-cbz-3-azabicyclo[3.1.0]hexane-6-carboxylic acid is 1417556-03-6.
The molecular formula of Endo-3-cbz-3-azabicyclo[3.1.0]hexane-6-carboxylic acid is C14H15NO4.
The molecular weight of Endo-3-cbz-3-azabicyclo[3.1.0]hexane-6-carboxylic acid is 261.1001 g/mol.
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