3-(3-oxo-3-{4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl}propyl)-4H-pyrido[2,1-c][1,2,4]triazin-4-one
Chemical Structure Depiction of
3-(3-oxo-3-{4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl}propyl)-4H-pyrido[2,1-c][1,2,4]triazin-4-one
3-(3-oxo-3-{4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl}propyl)-4H-pyrido[2,1-c][1,2,4]triazin-4-one
Compound characteristics
| Compound ID: | Y042-1486 |
| Compound Name: | 3-(3-oxo-3-{4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl}propyl)-4H-pyrido[2,1-c][1,2,4]triazin-4-one |
| Molecular Weight: | 432.4 |
| Molecular Formula: | C20 H19 F3 N6 O2 |
| Smiles: | C(CC(N1CCN(CC1)c1ccc(cn1)C(F)(F)F)=O)C1C(N2C=CC=CC2=NN=1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1504 |
| logD: | 2.1504 |
| logSw: | -2.2009 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 63.937 |
| InChI Key: | IXSMNJPOCAOLQV-UHFFFAOYSA-N |