5-ethyl-7-{2-oxo-2-[4-(pyridin-2-yl)piperazin-1-yl]ethyl}thieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8(7H)-one
Chemical Structure Depiction of
5-ethyl-7-{2-oxo-2-[4-(pyridin-2-yl)piperazin-1-yl]ethyl}thieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8(7H)-one
5-ethyl-7-{2-oxo-2-[4-(pyridin-2-yl)piperazin-1-yl]ethyl}thieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8(7H)-one
Compound characteristics
| Compound ID: | C785-1999 |
| Compound Name: | 5-ethyl-7-{2-oxo-2-[4-(pyridin-2-yl)piperazin-1-yl]ethyl}thieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8(7H)-one |
| Molecular Weight: | 422.51 |
| Molecular Formula: | C21 H22 N6 O2 S |
| Smiles: | CCC1=NN(CC(N2CCN(CC2)c2ccccn2)=O)C(c2cc3c(ccs3)n12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3069 |
| logD: | 2.298 |
| logSw: | -2.6188 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 59.65 |
| InChI Key: | FJZSAQWHZVUKMA-UHFFFAOYSA-N |