2-{[(6-chloro-2H-1,3-benzodioxol-5-yl)methyl]sulfanyl}-6-(difluoromethyl)-4-methylpyridine-3-carbonitrile
Chemical Structure Depiction of
2-{[(6-chloro-2H-1,3-benzodioxol-5-yl)methyl]sulfanyl}-6-(difluoromethyl)-4-methylpyridine-3-carbonitrile
2-{[(6-chloro-2H-1,3-benzodioxol-5-yl)methyl]sulfanyl}-6-(difluoromethyl)-4-methylpyridine-3-carbonitrile
Compound characteristics
| Compound ID: | Y500-7571 |
| Compound Name: | 2-{[(6-chloro-2H-1,3-benzodioxol-5-yl)methyl]sulfanyl}-6-(difluoromethyl)-4-methylpyridine-3-carbonitrile |
| Molecular Weight: | 368.79 |
| Molecular Formula: | C16 H11 Cl F2 N2 O2 S |
| Smiles: | Cc1cc(C(F)F)nc(c1C#N)SCc1cc2c(cc1[Cl])OCO2 |
| Stereo: | ACHIRAL |
| logP: | 4.7288 |
| logD: | 4.7288 |
| logSw: | -5.0229 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.886 |
| InChI Key: | HKLWFZBWFCJZTQ-UHFFFAOYSA-N |