5-ethyl-7-(1-oxo-1-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}propan-2-yl)furo[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8(7H)-one
Chemical Structure Depiction of
5-ethyl-7-(1-oxo-1-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}propan-2-yl)furo[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8(7H)-one
5-ethyl-7-(1-oxo-1-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}propan-2-yl)furo[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8(7H)-one
Compound characteristics
| Compound ID: | C887-0905 |
| Compound Name: | 5-ethyl-7-(1-oxo-1-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}propan-2-yl)furo[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8(7H)-one |
| Molecular Weight: | 487.48 |
| Molecular Formula: | C24 H24 F3 N5 O3 |
| Smiles: | CCC1=NN(C(C)C(N2CCN(CC2)c2cccc(c2)C(F)(F)F)=O)C(c2cc3c(cco3)n12)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5144 |
| logD: | 3.5144 |
| logSw: | -3.7381 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 57.653 |
| InChI Key: | RXTDIZCVDBDJHF-HNNXBMFYSA-N |