N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(7-methyl-3-oxo[1,2,4]triazolo[4,3-c]quinazolin-2(3H)-yl)acetamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(7-methyl-3-oxo[1,2,4]triazolo[4,3-c]quinazolin-2(3H)-yl)acetamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(7-methyl-3-oxo[1,2,4]triazolo[4,3-c]quinazolin-2(3H)-yl)acetamide
Compound characteristics
| Compound ID: | F810-0866 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(7-methyl-3-oxo[1,2,4]triazolo[4,3-c]quinazolin-2(3H)-yl)acetamide |
| Molecular Weight: | 391.38 |
| Molecular Formula: | C20 H17 N5 O4 |
| Smiles: | Cc1cccc2C3=NN(CC(NCc4ccc5c(c4)OCO5)=O)C(N3C=Nc12)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9791 |
| logD: | 1.979 |
| logSw: | -2.88 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.022 |
| InChI Key: | JQAMEFNPDALJEZ-UHFFFAOYSA-N |