2-(3-oxo-3,5,6,7,8,9-hexahydro-2H-cyclohepta[c]pyridazin-2-yl)-N-[3-(trifluoromethyl)phenyl]acetamide
Chemical Structure Depiction of
2-(3-oxo-3,5,6,7,8,9-hexahydro-2H-cyclohepta[c]pyridazin-2-yl)-N-[3-(trifluoromethyl)phenyl]acetamide
2-(3-oxo-3,5,6,7,8,9-hexahydro-2H-cyclohepta[c]pyridazin-2-yl)-N-[3-(trifluoromethyl)phenyl]acetamide
Compound characteristics
| Compound ID: | J102-0111 |
| Compound Name: | 2-(3-oxo-3,5,6,7,8,9-hexahydro-2H-cyclohepta[c]pyridazin-2-yl)-N-[3-(trifluoromethyl)phenyl]acetamide |
| Molecular Weight: | 365.35 |
| Molecular Formula: | C18 H18 F3 N3 O2 |
| Smiles: | C1CCC2=CC(N(CC(Nc3cccc(c3)C(F)(F)F)=O)N=C2CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6709 |
| logD: | 3.6706 |
| logSw: | -4.0496 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.713 |
| InChI Key: | MBVGPMPXIUAYNQ-UHFFFAOYSA-N |