2-[3-hydroxy-3-(trifluoromethyl)-3a,4,5,6,7,8-hexahydrocyclohepta[c]pyrazol-2(3H)-yl]-N-(2-methoxyphenyl)-2-oxoacetamide
Chemical Structure Depiction of
2-[3-hydroxy-3-(trifluoromethyl)-3a,4,5,6,7,8-hexahydrocyclohepta[c]pyrazol-2(3H)-yl]-N-(2-methoxyphenyl)-2-oxoacetamide
2-[3-hydroxy-3-(trifluoromethyl)-3a,4,5,6,7,8-hexahydrocyclohepta[c]pyrazol-2(3H)-yl]-N-(2-methoxyphenyl)-2-oxoacetamide
Compound characteristics
| Compound ID: | 6900-0213 |
| Compound Name: | 2-[3-hydroxy-3-(trifluoromethyl)-3a,4,5,6,7,8-hexahydrocyclohepta[c]pyrazol-2(3H)-yl]-N-(2-methoxyphenyl)-2-oxoacetamide |
| Molecular Weight: | 399.37 |
| Molecular Formula: | C18 H20 F3 N3 O4 |
| Smiles: | COc1ccccc1NC(C(N1C(C2CCCCCC2=N1)(C(F)(F)F)O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.1089 |
| logD: | 1.977 |
| logSw: | -3.4215 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.547 |
| InChI Key: | YWVYJLXJWXUIBT-UHFFFAOYSA-N |