2-(4,8-dimethyl-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)-N-(2,5-dimethylphenyl)butanamide
Chemical Structure Depiction of
2-(4,8-dimethyl-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)-N-(2,5-dimethylphenyl)butanamide
2-(4,8-dimethyl-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)-N-(2,5-dimethylphenyl)butanamide
Compound characteristics
| Compound ID: | C888-0538 |
| Compound Name: | 2-(4,8-dimethyl-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)-N-(2,5-dimethylphenyl)butanamide |
| Molecular Weight: | 402.5 |
| Molecular Formula: | C24 H26 N4 O2 |
| Smiles: | CCC(C(Nc1cc(C)ccc1C)=O)N1C(c2cc3cc(C)ccc3n2C(C)=N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8227 |
| logD: | 4.8227 |
| logSw: | -4.6544 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.159 |
| InChI Key: | DPBJVNSJCRPJTE-FQEVSTJZSA-N |