2-(8-fluoro-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)-N-(3-phenylpropyl)acetamide
Chemical Structure Depiction of
2-(8-fluoro-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)-N-(3-phenylpropyl)acetamide
2-(8-fluoro-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)-N-(3-phenylpropyl)acetamide
Compound characteristics
| Compound ID: | C786-3978 |
| Compound Name: | 2-(8-fluoro-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)-N-(3-phenylpropyl)acetamide |
| Molecular Weight: | 378.4 |
| Molecular Formula: | C21 H19 F N4 O2 |
| Smiles: | C(Cc1ccccc1)CNC(CN1C(c2cc3cc(ccc3n2C=N1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8019 |
| logD: | 2.8019 |
| logSw: | -3.2995 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.997 |
| InChI Key: | NSQQMSRDCYXRHN-UHFFFAOYSA-N |