N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-2-[4-oxo-2-(thiophen-2-yl)pyrazolo[1,5-d][1,2,4]triazin-5(4H)-yl]acetamide
Chemical Structure Depiction of
N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-2-[4-oxo-2-(thiophen-2-yl)pyrazolo[1,5-d][1,2,4]triazin-5(4H)-yl]acetamide
N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-2-[4-oxo-2-(thiophen-2-yl)pyrazolo[1,5-d][1,2,4]triazin-5(4H)-yl]acetamide
Compound characteristics
| Compound ID: | E016-0509 |
| Compound Name: | N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-2-[4-oxo-2-(thiophen-2-yl)pyrazolo[1,5-d][1,2,4]triazin-5(4H)-yl]acetamide |
| Molecular Weight: | 428.56 |
| Molecular Formula: | C21 H28 N6 O2 S |
| Smiles: | CC1CC(C)CN(CCCNC(CN2C(c3cc(c4cccs4)nn3C=N2)=O)=O)C1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.7369 |
| logD: | -0.868 |
| logSw: | -2.5554 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.326 |
| InChI Key: | VKDMLIRGFGMQOT-UHFFFAOYSA-N |