7-[4-(3,5-dimethylpiperidin-1-yl)-4-oxobutyl]-5-methylthieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8(7H)-one
Chemical Structure Depiction of
7-[4-(3,5-dimethylpiperidin-1-yl)-4-oxobutyl]-5-methylthieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8(7H)-one
7-[4-(3,5-dimethylpiperidin-1-yl)-4-oxobutyl]-5-methylthieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8(7H)-one
Compound characteristics
| Compound ID: | C785-2602 |
| Compound Name: | 7-[4-(3,5-dimethylpiperidin-1-yl)-4-oxobutyl]-5-methylthieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8(7H)-one |
| Molecular Weight: | 386.51 |
| Molecular Formula: | C20 H26 N4 O2 S |
| Smiles: | CC1CC(C)CN(C1)C(CCCN1C(c2cc3c(ccs3)n2C(C)=N1)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.7915 |
| logD: | 2.7901 |
| logSw: | -3.1281 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 46.632 |
| InChI Key: | LYPRDGSGYHCDDD-UHFFFAOYSA-N |