1-({[4-(difluoromethyl)-6-(4-methylphenyl)pyrimidin-2-yl]sulfanyl}methyl)-3,3-dimethyl-3,4-dihydroisoquinoline
Chemical Structure Depiction of
1-({[4-(difluoromethyl)-6-(4-methylphenyl)pyrimidin-2-yl]sulfanyl}methyl)-3,3-dimethyl-3,4-dihydroisoquinoline
1-({[4-(difluoromethyl)-6-(4-methylphenyl)pyrimidin-2-yl]sulfanyl}methyl)-3,3-dimethyl-3,4-dihydroisoquinoline
Compound characteristics
| Compound ID: | 8013-1173 |
| Compound Name: | 1-({[4-(difluoromethyl)-6-(4-methylphenyl)pyrimidin-2-yl]sulfanyl}methyl)-3,3-dimethyl-3,4-dihydroisoquinoline |
| Molecular Weight: | 423.53 |
| Molecular Formula: | C24 H23 F2 N3 S |
| Smiles: | Cc1ccc(cc1)c1cc(C(F)F)nc(n1)SCC1c2ccccc2CC(C)(C)N=1 |
| Stereo: | ACHIRAL |
| logP: | 6.3411 |
| logD: | 6.2318 |
| logSw: | -5.8755 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 24.7644 |
| InChI Key: | VYPGHBXGBXYBKQ-UHFFFAOYSA-N |