5-ethyl-7-{2-[4-(furan-2-carbonyl)piperazin-1-yl]-2-oxoethyl}thieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8(7H)-one
Chemical Structure Depiction of
5-ethyl-7-{2-[4-(furan-2-carbonyl)piperazin-1-yl]-2-oxoethyl}thieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8(7H)-one
5-ethyl-7-{2-[4-(furan-2-carbonyl)piperazin-1-yl]-2-oxoethyl}thieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8(7H)-one
Compound characteristics
| Compound ID: | C785-2006 |
| Compound Name: | 5-ethyl-7-{2-[4-(furan-2-carbonyl)piperazin-1-yl]-2-oxoethyl}thieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8(7H)-one |
| Molecular Weight: | 439.49 |
| Molecular Formula: | C21 H21 N5 O4 S |
| Smiles: | CCC1=NN(CC(N2CCN(CC2)C(c2ccco2)=O)=O)C(c2cc3c(ccs3)n12)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2122 |
| logD: | 1.2122 |
| logSw: | -2.2116 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 72.913 |
| InChI Key: | GGWQIEFPUQPERD-UHFFFAOYSA-N |