N-(2,4-dimethylphenyl)-2-(2,2,2-trifluoroacetamido)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
Chemical Structure Depiction of
N-(2,4-dimethylphenyl)-2-(2,2,2-trifluoroacetamido)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
N-(2,4-dimethylphenyl)-2-(2,2,2-trifluoroacetamido)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
Compound characteristics
| Compound ID: | 3261-0887 |
| Compound Name: | N-(2,4-dimethylphenyl)-2-(2,2,2-trifluoroacetamido)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide |
| Molecular Weight: | 410.46 |
| Molecular Formula: | C20 H21 F3 N2 O2 S |
| Smiles: | Cc1ccc(c(C)c1)NC(c1c2CCCCCc2sc1NC(C(F)(F)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4807 |
| logD: | 1.9524 |
| logSw: | -5.2682 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 46.041 |
| InChI Key: | BYXXEJXNSMFKLB-UHFFFAOYSA-N |