1-[8-(4-ethyl-4H-1,2,4-triazol-3-yl)-6-azaspiro[3.4]octan-6-yl]-2-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]ethan-1-one
Chemical Structure Depiction of
1-[8-(4-ethyl-4H-1,2,4-triazol-3-yl)-6-azaspiro[3.4]octan-6-yl]-2-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]ethan-1-one
1-[8-(4-ethyl-4H-1,2,4-triazol-3-yl)-6-azaspiro[3.4]octan-6-yl]-2-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | SD74-0188 |
| Compound Name: | 1-[8-(4-ethyl-4H-1,2,4-triazol-3-yl)-6-azaspiro[3.4]octan-6-yl]-2-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]ethan-1-one |
| Molecular Weight: | 396.41 |
| Molecular Formula: | C18 H23 F3 N6 O |
| Smiles: | CCn1cnnc1C1CN(CC12CCC2)C(Cn1c(C)cc(C(F)(F)F)n1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.7929 |
| logD: | 0.7925 |
| logSw: | -0.9535 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 55.125 |
| InChI Key: | YDZLNLDCKLERLJ-ZDUSSCGKSA-N |