N-benzyl-2-(8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)acetamide
Chemical Structure Depiction of
N-benzyl-2-(8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)acetamide
N-benzyl-2-(8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)acetamide
Compound characteristics
| Compound ID: | C785-0030 |
| Compound Name: | N-benzyl-2-(8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)acetamide |
| Molecular Weight: | 338.39 |
| Molecular Formula: | C17 H14 N4 O2 S |
| Smiles: | C(c1ccccc1)NC(CN1C(c2cc3c(ccs3)n2C=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6549 |
| logD: | 1.6549 |
| logSw: | -2.5402 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.173 |
| InChI Key: | PRUBWJLVMPHMQH-UHFFFAOYSA-N |