2-(5-ethyl-2-methyl-8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)-N-[3-(propylsulfanyl)propyl]acetamide
Chemical Structure Depiction of
2-(5-ethyl-2-methyl-8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)-N-[3-(propylsulfanyl)propyl]acetamide
2-(5-ethyl-2-methyl-8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)-N-[3-(propylsulfanyl)propyl]acetamide
Compound characteristics
| Compound ID: | C785-3090 |
| Compound Name: | 2-(5-ethyl-2-methyl-8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)-N-[3-(propylsulfanyl)propyl]acetamide |
| Molecular Weight: | 406.57 |
| Molecular Formula: | C19 H26 N4 O2 S2 |
| Smiles: | CCCSCCCNC(CN1C(c2cc3c(cc(C)s3)n2C(CC)=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9716 |
| logD: | 2.9716 |
| logSw: | -3.1407 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.07 |
| InChI Key: | NWMYXFSEPJJPCH-UHFFFAOYSA-N |