5-ethyl-7-(2-oxo-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethyl)furo[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-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethyl)furo[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8(7H)-one
5-ethyl-7-(2-oxo-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethyl)furo[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8(7H)-one
Compound characteristics
| Compound ID: | C887-0326 |
| Compound Name: | 5-ethyl-7-(2-oxo-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethyl)furo[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8(7H)-one |
| Molecular Weight: | 473.45 |
| Molecular Formula: | C23 H22 F3 N5 O3 |
| Smiles: | CCC1=NN(CC(N2CCN(CC2)c2cccc(c2)C(F)(F)F)=O)C(c2cc3c(cco3)n12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8158 |
| logD: | 2.8158 |
| logSw: | -3.0698 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 58.592 |
| InChI Key: | SNWGCXGUEIGBLT-UHFFFAOYSA-N |