3,4-dimethyl-6-(2-oxo-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethyl)[1,2]oxazolo[3,4-d]pyridazin-7(6H)-one
Chemical Structure Depiction of
3,4-dimethyl-6-(2-oxo-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethyl)[1,2]oxazolo[3,4-d]pyridazin-7(6H)-one
3,4-dimethyl-6-(2-oxo-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethyl)[1,2]oxazolo[3,4-d]pyridazin-7(6H)-one
Compound characteristics
| Compound ID: | F270-0558 |
| Compound Name: | 3,4-dimethyl-6-(2-oxo-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethyl)[1,2]oxazolo[3,4-d]pyridazin-7(6H)-one |
| Molecular Weight: | 435.4 |
| Molecular Formula: | C20 H20 F3 N5 O3 |
| Smiles: | CC1c2c(C(N(CC(N3CCN(CC3)c3cccc(c3)C(F)(F)F)=O)N=1)=O)noc2C |
| Stereo: | ACHIRAL |
| logP: | 1.8775 |
| logD: | 1.8775 |
| logSw: | -2.3672 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 68.615 |
| InChI Key: | XOKIEWQIAUDSBM-UHFFFAOYSA-N |