N-(3-methylbutyl)-2-(4-methyl-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)acetamide
Chemical Structure Depiction of
N-(3-methylbutyl)-2-(4-methyl-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)acetamide
N-(3-methylbutyl)-2-(4-methyl-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)acetamide
Compound characteristics
| Compound ID: | C888-0116 |
| Compound Name: | N-(3-methylbutyl)-2-(4-methyl-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)acetamide |
| Molecular Weight: | 326.4 |
| Molecular Formula: | C18 H22 N4 O2 |
| Smiles: | CC(C)CCNC(CN1C(c2cc3ccccc3n2C(C)=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4706 |
| logD: | 2.4706 |
| logSw: | -3.0935 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.96 |
| InChI Key: | NGGDQNVDTINJSU-UHFFFAOYSA-N |