N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)acetamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)acetamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)acetamide
Compound characteristics
| Compound ID: | C786-0066 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)acetamide |
| Molecular Weight: | 376.37 |
| Molecular Formula: | C20 H16 N4 O4 |
| Smiles: | C(c1ccc2c(c1)OCO2)NC(CN1C(c2cc3ccccc3n2C=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8755 |
| logD: | 1.8755 |
| logSw: | -2.8167 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.271 |
| InChI Key: | LNTXOXCIZUBRQA-UHFFFAOYSA-N |