N-(1-benzylpiperidin-4-yl)-2-(8-fluoro-4-methyl-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)acetamide
Chemical Structure Depiction of
N-(1-benzylpiperidin-4-yl)-2-(8-fluoro-4-methyl-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)acetamide
N-(1-benzylpiperidin-4-yl)-2-(8-fluoro-4-methyl-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)acetamide
Compound characteristics
| Compound ID: | C786-4351 |
| Compound Name: | N-(1-benzylpiperidin-4-yl)-2-(8-fluoro-4-methyl-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)acetamide |
| Molecular Weight: | 447.51 |
| Molecular Formula: | C25 H26 F N5 O2 |
| Smiles: | CC1=NN(CC(NC2CCN(CC2)Cc2ccccc2)=O)C(c2cc3cc(ccc3n12)F)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8165 |
| logD: | 1.2588 |
| logSw: | -3.2558 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.113 |
| InChI Key: | YTXZQMORCGUZHV-UHFFFAOYSA-N |