N-[3-(2,6-dimethylpiperidin-1-yl)propyl]-2-(5-ethyl-8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)acetamide
Chemical Structure Depiction of
N-[3-(2,6-dimethylpiperidin-1-yl)propyl]-2-(5-ethyl-8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)acetamide
N-[3-(2,6-dimethylpiperidin-1-yl)propyl]-2-(5-ethyl-8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)acetamide
Compound characteristics
Compound ID: | C785-1920 |
Compound Name: | N-[3-(2,6-dimethylpiperidin-1-yl)propyl]-2-(5-ethyl-8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)acetamide |
Molecular Weight: | 429.58 |
Molecular Formula: | C22 H31 N5 O2 S |
Smiles: | CCC1=NN(CC(NCCCN2C(C)CCCC2C)=O)C(c2cc3c(ccs3)n12)=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 2.3841 |
logD: | -0.7748 |
logSw: | -2.8745 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 58.337 |
InChI Key: | NJDLGULWXPZTSU-UHFFFAOYSA-N |