7,8-dimethoxy-5-methyl-3-{[3-(trifluoromethyl)phenyl]methyl}-3,5-dihydro-4H-pyridazino[4,5-b]indol-4-one
Chemical Structure Depiction of
7,8-dimethoxy-5-methyl-3-{[3-(trifluoromethyl)phenyl]methyl}-3,5-dihydro-4H-pyridazino[4,5-b]indol-4-one
7,8-dimethoxy-5-methyl-3-{[3-(trifluoromethyl)phenyl]methyl}-3,5-dihydro-4H-pyridazino[4,5-b]indol-4-one
Compound characteristics
| Compound ID: | Y042-1054 |
| Compound Name: | 7,8-dimethoxy-5-methyl-3-{[3-(trifluoromethyl)phenyl]methyl}-3,5-dihydro-4H-pyridazino[4,5-b]indol-4-one |
| Molecular Weight: | 417.39 |
| Molecular Formula: | C21 H18 F3 N3 O3 |
| Smiles: | Cn1c2C(N(Cc3cccc(c3)C(F)(F)F)N=Cc2c2cc(c(cc12)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1841 |
| logD: | 3.1837 |
| logSw: | -3.2889 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 45.414 |
| InChI Key: | FMBYRORNRCQEBN-UHFFFAOYSA-N |