N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-2-(8-oxofuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)butanamide
Chemical Structure Depiction of
N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-2-(8-oxofuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)butanamide
N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-2-(8-oxofuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)butanamide
Compound characteristics
| Compound ID: | C795-0647 |
| Compound Name: | N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-2-(8-oxofuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)butanamide |
| Molecular Weight: | 413.52 |
| Molecular Formula: | C22 H31 N5 O3 |
| Smiles: | CCC(C(NCCCN1CC(C)CC(C)C1)=O)N1C(c2cc3c(cco3)n2C=N1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.3703 |
| logD: | -0.2345 |
| logSw: | -2.8671 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.649 |
| InChI Key: | XYZIQXAOCVCUHG-UHFFFAOYSA-N |