N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(4-ethyl-6-oxo-2-phenylpyrimidin-1(6H)-yl)acetamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(4-ethyl-6-oxo-2-phenylpyrimidin-1(6H)-yl)acetamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(4-ethyl-6-oxo-2-phenylpyrimidin-1(6H)-yl)acetamide
Compound characteristics
| Compound ID: | P196-0590 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(4-ethyl-6-oxo-2-phenylpyrimidin-1(6H)-yl)acetamide |
| Molecular Weight: | 391.43 |
| Molecular Formula: | C22 H21 N3 O4 |
| Smiles: | CCC1=CC(N(CC(NCc2ccc3c(c2)OCO3)=O)C(c2ccccc2)=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7796 |
| logD: | 2.7788 |
| logSw: | -3.2766 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.677 |
| InChI Key: | MORWHQPBMZIZTA-UHFFFAOYSA-N |