2-{[(3,3-dimethyl-3,4-dihydroisoquinolin-1-yl)methyl]sulfanyl}-4-(trifluoromethyl)-5H-indeno[1,2-d]pyrimidine
Chemical Structure Depiction of
2-{[(3,3-dimethyl-3,4-dihydroisoquinolin-1-yl)methyl]sulfanyl}-4-(trifluoromethyl)-5H-indeno[1,2-d]pyrimidine
2-{[(3,3-dimethyl-3,4-dihydroisoquinolin-1-yl)methyl]sulfanyl}-4-(trifluoromethyl)-5H-indeno[1,2-d]pyrimidine
Compound characteristics
| Compound ID: | 8013-2302 |
| Compound Name: | 2-{[(3,3-dimethyl-3,4-dihydroisoquinolin-1-yl)methyl]sulfanyl}-4-(trifluoromethyl)-5H-indeno[1,2-d]pyrimidine |
| Molecular Weight: | 439.5 |
| Molecular Formula: | C24 H20 F3 N3 S |
| Smiles: | CC1(C)Cc2ccccc2C(CSc2nc3c4ccccc4Cc3c(C(F)(F)F)n2)=N1 |
| Stereo: | ACHIRAL |
| logP: | 6.5294 |
| logD: | 6.4201 |
| logSw: | -6.1629 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 26.6826 |
| InChI Key: | AZHVTODGFUOLTF-UHFFFAOYSA-N |