N-[2-(dibutylamino)ethyl]-2-(5-methyl-8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)acetamide
Chemical Structure Depiction of
N-[2-(dibutylamino)ethyl]-2-(5-methyl-8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)acetamide
N-[2-(dibutylamino)ethyl]-2-(5-methyl-8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)acetamide
Compound characteristics
| Compound ID: | C785-1639 |
| Compound Name: | N-[2-(dibutylamino)ethyl]-2-(5-methyl-8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)acetamide |
| Molecular Weight: | 417.57 |
| Molecular Formula: | C21 H31 N5 O2 S |
| Smiles: | CCCCN(CCCC)CCNC(CN1C(c2cc3c(ccs3)n2C(C)=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1577 |
| logD: | 1.5812 |
| logSw: | -3.1609 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.897 |
| InChI Key: | YFBKNYPNAUTTCH-UHFFFAOYSA-N |