N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(4-ethyl-9-methoxy-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)acetamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(4-ethyl-9-methoxy-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)acetamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(4-ethyl-9-methoxy-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)acetamide
Compound characteristics
| Compound ID: | C786-2726 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(4-ethyl-9-methoxy-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)acetamide |
| Molecular Weight: | 464.52 |
| Molecular Formula: | C25 H28 N4 O5 |
| Smiles: | CCC1=NN(CC(NCCc2ccc(c(c2)OC)OC)=O)C(c2cc3c(cccc3n12)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2581 |
| logD: | 2.2581 |
| logSw: | -2.8852 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.672 |
| InChI Key: | WKOBESXHVZBOQQ-UHFFFAOYSA-N |