N-[(4-methylphenyl)methyl]-2-(1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)acetamide
Chemical Structure Depiction of
N-[(4-methylphenyl)methyl]-2-(1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)acetamide
N-[(4-methylphenyl)methyl]-2-(1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)acetamide
Compound characteristics
| Compound ID: | C786-0063 |
| Compound Name: | N-[(4-methylphenyl)methyl]-2-(1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)acetamide |
| Molecular Weight: | 346.39 |
| Molecular Formula: | C20 H18 N4 O2 |
| Smiles: | Cc1ccc(CNC(CN2C(c3cc4ccccc4n3C=N2)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.3858 |
| logD: | 2.3858 |
| logSw: | -3.0092 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.155 |
| InChI Key: | IAULPYAPOPHROV-UHFFFAOYSA-N |