N-[(2-ethoxyphenyl)methyl]-2-(8-fluoro-4-methyl-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)acetamide
Chemical Structure Depiction of
N-[(2-ethoxyphenyl)methyl]-2-(8-fluoro-4-methyl-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)acetamide
N-[(2-ethoxyphenyl)methyl]-2-(8-fluoro-4-methyl-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)acetamide
Compound characteristics
| Compound ID: | C786-4425 |
| Compound Name: | N-[(2-ethoxyphenyl)methyl]-2-(8-fluoro-4-methyl-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)acetamide |
| Molecular Weight: | 408.43 |
| Molecular Formula: | C22 H21 F N4 O3 |
| Smiles: | CCOc1ccccc1CNC(CN1C(c2cc3cc(ccc3n2C(C)=N1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3007 |
| logD: | 3.3007 |
| logSw: | -3.4303 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.058 |
| InChI Key: | DMVBCJBQNODOGE-UHFFFAOYSA-N |