N-(2H-1,3-benzodioxol-5-yl)-2-(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)-2-(3-oxo[1,2,4]triazolo[4,3-c]quinazolin-2(3H)-yl)acetamide
N-(2H-1,3-benzodioxol-5-yl)-2-(3-oxo[1,2,4]triazolo[4,3-c]quinazolin-2(3H)-yl)acetamide
Compound characteristics
| Compound ID: | F810-0018 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-2-(3-oxo[1,2,4]triazolo[4,3-c]quinazolin-2(3H)-yl)acetamide |
| Molecular Weight: | 363.33 |
| Molecular Formula: | C18 H13 N5 O4 |
| Smiles: | C(C(Nc1ccc2c(c1)OCO2)=O)N1C(N2C=Nc3ccccc3C2=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8476 |
| logD: | 1.8475 |
| logSw: | -2.9225 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.952 |
| InChI Key: | BXGUHKZCHCWMGA-UHFFFAOYSA-N |