N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(4-ethyl-9-methoxy-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-(4-ethyl-9-methoxy-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)acetamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(4-ethyl-9-methoxy-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)acetamide
Compound characteristics
Compound ID: | C786-2742 |
Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(4-ethyl-9-methoxy-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)acetamide |
Molecular Weight: | 434.45 |
Molecular Formula: | C23 H22 N4 O5 |
Smiles: | CCC1=NN(CC(NCc2ccc3c(c2)OCO3)=O)C(c2cc3c(cccc3n12)OC)=O |
Stereo: | ACHIRAL |
logP: | 2.8794 |
logD: | 2.8794 |
logSw: | -3.1971 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 79.685 |
InChI Key: | ATBLVSVJPZGSTN-UHFFFAOYSA-N |