N-(2H-1,3-benzodioxol-5-yl)-2-{[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-2-{[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}acetamide
N-(2H-1,3-benzodioxol-5-yl)-2-{[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}acetamide
Compound characteristics
Compound ID: | 6466-0809 |
Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-2-{[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}acetamide |
Molecular Weight: | 423.37 |
Molecular Formula: | C18 H12 F3 N3 O4 S |
Smiles: | C1Oc2ccc(cc2O1)NC(CSc1nc(cc(C(F)(F)F)n1)c1ccco1)=O |
Stereo: | ACHIRAL |
logP: | 4.0485 |
logD: | 4.0485 |
logSw: | -4.2195 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 65.832 |
InChI Key: | JCTXSHOFDBGZPQ-UHFFFAOYSA-N |