N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-4-(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]-4-(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]-4-(8-oxofuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)butanamide
Compound characteristics
| Compound ID: | C795-0651 |
| Compound Name: | N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-4-(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: | CC1CC(C)CN(CCCNC(CCCN2C(c3cc4c(cco4)n3C=N2)=O)=O)C1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 0.8788 |
| logD: | -1.726 |
| logSw: | -1.9923 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.296 |
| InChI Key: | WPOCQWAKDCPNLT-UHFFFAOYSA-N |