2-[3-(3,5-dimethyl-1H-pyrazol-1-yl)-5H-[1,2,4]triazino[5,6-b]indol-5-yl]-1-(piperidin-1-yl)ethan-1-one
Chemical Structure Depiction of
2-[3-(3,5-dimethyl-1H-pyrazol-1-yl)-5H-[1,2,4]triazino[5,6-b]indol-5-yl]-1-(piperidin-1-yl)ethan-1-one
2-[3-(3,5-dimethyl-1H-pyrazol-1-yl)-5H-[1,2,4]triazino[5,6-b]indol-5-yl]-1-(piperidin-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | D699-0117 |
| Compound Name: | 2-[3-(3,5-dimethyl-1H-pyrazol-1-yl)-5H-[1,2,4]triazino[5,6-b]indol-5-yl]-1-(piperidin-1-yl)ethan-1-one |
| Molecular Weight: | 389.46 |
| Molecular Formula: | C21 H23 N7 O |
| Smiles: | Cc1cc(C)n(c2nc3c(c4ccccc4n3CC(N3CCCCC3)=O)nn2)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.2061 |
| logD: | 2.2053 |
| logSw: | -2.6822 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 63.447 |
| InChI Key: | KGYFYAYCRLHLCH-UHFFFAOYSA-N |