N-(1-benzylpiperidin-4-yl)-2-(4-ethyl-9-methoxy-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)acetamide
Chemical Structure Depiction of
N-(1-benzylpiperidin-4-yl)-2-(4-ethyl-9-methoxy-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)acetamide
N-(1-benzylpiperidin-4-yl)-2-(4-ethyl-9-methoxy-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)acetamide
Compound characteristics
| Compound ID: | C786-2789 |
| Compound Name: | N-(1-benzylpiperidin-4-yl)-2-(4-ethyl-9-methoxy-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)acetamide |
| Molecular Weight: | 473.57 |
| Molecular Formula: | C27 H31 N5 O3 |
| Smiles: | CCC1=NN(CC(NC2CCN(CC2)Cc2ccccc2)=O)C(c2cc3c(cccc3n12)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0914 |
| logD: | 1.5337 |
| logSw: | -3.1869 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.835 |
| InChI Key: | KYJWSSDNKRZACV-UHFFFAOYSA-N |