N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-phenylbutanamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-phenylbutanamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-phenylbutanamide
Compound characteristics
| Compound ID: | Y030-5560 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-phenylbutanamide |
| Molecular Weight: | 297.35 |
| Molecular Formula: | C18 H19 N O3 |
| Smiles: | CCC(C(NCc1ccc2c(c1)OCO2)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.363 |
| logD: | 3.363 |
| logSw: | -3.4779 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.767 |
| InChI Key: | CYIVBBGXBGMIPL-OAHLLOKOSA-N |