N-(2,3-dimethylcyclohexyl)-2-(4,8-dimethyl-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)acetamide
Chemical Structure Depiction of
N-(2,3-dimethylcyclohexyl)-2-(4,8-dimethyl-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)acetamide
N-(2,3-dimethylcyclohexyl)-2-(4,8-dimethyl-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)acetamide
Compound characteristics
| Compound ID: | C786-1625 |
| Compound Name: | N-(2,3-dimethylcyclohexyl)-2-(4,8-dimethyl-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)acetamide |
| Molecular Weight: | 380.49 |
| Molecular Formula: | C22 H28 N4 O2 |
| Smiles: | CC1CCCC(C1C)NC(CN1C(c2cc3cc(C)ccc3n2C(C)=N1)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.4786 |
| logD: | 3.4786 |
| logSw: | -3.6393 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.963 |
| InChI Key: | DOTASNKVCXYZBD-UHFFFAOYSA-N |