N-[(4-butoxyphenyl)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-[(4-butoxyphenyl)methyl]-2-(4-ethyl-9-methoxy-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)acetamide
N-[(4-butoxyphenyl)methyl]-2-(4-ethyl-9-methoxy-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)acetamide
Compound characteristics
| Compound ID: | C786-2964 |
| Compound Name: | N-[(4-butoxyphenyl)methyl]-2-(4-ethyl-9-methoxy-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)acetamide |
| Molecular Weight: | 462.55 |
| Molecular Formula: | C26 H30 N4 O4 |
| Smiles: | CCCCOc1ccc(CNC(CN2C(c3cc4c(cccc4n3C(CC)=N2)OC)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.3986 |
| logD: | 4.3986 |
| logSw: | -4.2433 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.987 |
| InChI Key: | SCHHUVRPCKDANE-UHFFFAOYSA-N |