2-(5-ethyl-8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)-N-[3-(piperidin-1-yl)propyl]acetamide
Chemical Structure Depiction of
2-(5-ethyl-8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)-N-[3-(piperidin-1-yl)propyl]acetamide
2-(5-ethyl-8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)-N-[3-(piperidin-1-yl)propyl]acetamide
Compound characteristics
Compound ID: | C785-1892 |
Compound Name: | 2-(5-ethyl-8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)-N-[3-(piperidin-1-yl)propyl]acetamide |
Molecular Weight: | 401.53 |
Molecular Formula: | C20 H27 N5 O2 S |
Smiles: | CCC1=NN(CC(NCCCN2CCCCC2)=O)C(c2cc3c(ccs3)n12)=O |
Stereo: | ACHIRAL |
logP: | 1.7757 |
logD: | -0.8785 |
logSw: | -2.5475 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 59.782 |
InChI Key: | MTXXLCCFNJYJDB-UHFFFAOYSA-N |