3-(3,4-dimethylphenyl)-5-[(2-fluorophenyl)methyl]-8,9-dihydro-5H-[1,4]dioxino[2,3-g]pyrazolo[4,3-c]quinoline
Chemical Structure Depiction of
3-(3,4-dimethylphenyl)-5-[(2-fluorophenyl)methyl]-8,9-dihydro-5H-[1,4]dioxino[2,3-g]pyrazolo[4,3-c]quinoline
3-(3,4-dimethylphenyl)-5-[(2-fluorophenyl)methyl]-8,9-dihydro-5H-[1,4]dioxino[2,3-g]pyrazolo[4,3-c]quinoline
Compound characteristics
| Compound ID: | C645-0136 |
| Compound Name: | 3-(3,4-dimethylphenyl)-5-[(2-fluorophenyl)methyl]-8,9-dihydro-5H-[1,4]dioxino[2,3-g]pyrazolo[4,3-c]quinoline |
| Molecular Weight: | 439.49 |
| Molecular Formula: | C27 H22 F N3 O2 |
| Smiles: | Cc1ccc(cc1C)C1C2=CN(Cc3ccccc3F)c3cc4c(cc3C2=NN=1)OCCO4 |
| Stereo: | ACHIRAL |
| logP: | 5.2132 |
| logD: | 5.0418 |
| logSw: | -5.1228 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 36.151 |
| InChI Key: | GBSSMJYPGOCKAF-UHFFFAOYSA-N |