4-oxo-4-(2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl)butanoic acid
Chemical Structure Depiction of
4-oxo-4-(2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl)butanoic acid
4-oxo-4-(2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl)butanoic acid
Compound characteristics
| Compound ID: | FF01-2335 |
| Compound Name: | 4-oxo-4-(2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl)butanoic acid |
| Molecular Weight: | 247.29 |
| Molecular Formula: | C14 H17 N O3 |
| Smiles: | C1CCN(C(CCC(O)=O)=O)c2ccccc2C1 |
| Stereo: | ACHIRAL |
| logP: | 2.0234 |
| logD: | -0.926 |
| logSw: | -2.0496 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.01 |
| InChI Key: | XCEOETSOQLSHMA-UHFFFAOYSA-N |