4-(3,4-dimethyl-7-oxo-2-phenyl-2,7-dihydro-6H-pyrazolo[3,4-d]pyridazin-6-yl)-N-[3-(trifluoromethyl)phenyl]butanamide
Chemical Structure Depiction of
4-(3,4-dimethyl-7-oxo-2-phenyl-2,7-dihydro-6H-pyrazolo[3,4-d]pyridazin-6-yl)-N-[3-(trifluoromethyl)phenyl]butanamide
4-(3,4-dimethyl-7-oxo-2-phenyl-2,7-dihydro-6H-pyrazolo[3,4-d]pyridazin-6-yl)-N-[3-(trifluoromethyl)phenyl]butanamide
Compound characteristics
| Compound ID: | E854-2679 |
| Compound Name: | 4-(3,4-dimethyl-7-oxo-2-phenyl-2,7-dihydro-6H-pyrazolo[3,4-d]pyridazin-6-yl)-N-[3-(trifluoromethyl)phenyl]butanamide |
| Molecular Weight: | 469.47 |
| Molecular Formula: | C24 H22 F3 N5 O2 |
| Smiles: | CC1c2c(C(N(CCCC(Nc3cccc(c3)C(F)(F)F)=O)N=1)=O)nn(c1ccccc1)c2C |
| Stereo: | ACHIRAL |
| logP: | 3.6605 |
| logD: | 3.6593 |
| logSw: | -4.1581 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.47 |
| InChI Key: | QLYDAQSUYIZJEP-UHFFFAOYSA-N |