2-(4,8-dimethyl-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)-N-(4-fluorophenyl)butanamide
Chemical Structure Depiction of
2-(4,8-dimethyl-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)-N-(4-fluorophenyl)butanamide
2-(4,8-dimethyl-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)-N-(4-fluorophenyl)butanamide
Compound characteristics
| Compound ID: | C888-0539 |
| Compound Name: | 2-(4,8-dimethyl-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)-N-(4-fluorophenyl)butanamide |
| Molecular Weight: | 392.43 |
| Molecular Formula: | C22 H21 F N4 O2 |
| Smiles: | CCC(C(Nc1ccc(cc1)F)=O)N1C(c2cc3cc(C)ccc3n2C(C)=N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.512 |
| logD: | 4.5119 |
| logSw: | -4.3145 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.856 |
| InChI Key: | RWSVCXKNJBEXET-SFHVURJKSA-N |