N-(2-chlorophenyl)-2-(2,2,2-trifluoroacetamido)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
Chemical Structure Depiction of
N-(2-chlorophenyl)-2-(2,2,2-trifluoroacetamido)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
N-(2-chlorophenyl)-2-(2,2,2-trifluoroacetamido)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
Compound characteristics
| Compound ID: | 3261-0852 |
| Compound Name: | N-(2-chlorophenyl)-2-(2,2,2-trifluoroacetamido)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide |
| Molecular Weight: | 416.85 |
| Molecular Formula: | C18 H16 Cl F3 N2 O2 S |
| Smiles: | C1CCc2c(C(Nc3ccccc3[Cl])=O)c(NC(C(F)(F)F)=O)sc2CC1 |
| Stereo: | ACHIRAL |
| logP: | 5.0488 |
| logD: | 1.5206 |
| logSw: | -5.3985 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 46.041 |
| InChI Key: | DONFYSLXKGBNQK-UHFFFAOYSA-N |