N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[2-(3-cyano-4,6-dimethyl-2-oxopyridin-1(2H)-yl)acetamido]benzamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[2-(3-cyano-4,6-dimethyl-2-oxopyridin-1(2H)-yl)acetamido]benzamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[2-(3-cyano-4,6-dimethyl-2-oxopyridin-1(2H)-yl)acetamido]benzamide
Compound characteristics
| Compound ID: | G487-0567 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[2-(3-cyano-4,6-dimethyl-2-oxopyridin-1(2H)-yl)acetamido]benzamide |
| Molecular Weight: | 458.47 |
| Molecular Formula: | C25 H22 N4 O5 |
| Smiles: | CC1=CC(C)=C(C#N)C(N1CC(Nc1ccccc1C(NCc1ccc2c(c1)OCO2)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5526 |
| logD: | 2.5523 |
| logSw: | -3.1796 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 96.464 |
| InChI Key: | DBAQPCFLOXQCJF-UHFFFAOYSA-N |