1-(7-ethyl-7-hydroxy-5-oxa-2-azaspiro[3.4]octan-2-yl)-2-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]ethan-1-one
Chemical Structure Depiction of
1-(7-ethyl-7-hydroxy-5-oxa-2-azaspiro[3.4]octan-2-yl)-2-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]ethan-1-one
1-(7-ethyl-7-hydroxy-5-oxa-2-azaspiro[3.4]octan-2-yl)-2-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | SA47-0491 |
| Compound Name: | 1-(7-ethyl-7-hydroxy-5-oxa-2-azaspiro[3.4]octan-2-yl)-2-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]ethan-1-one |
| Molecular Weight: | 347.34 |
| Molecular Formula: | C15 H20 F3 N3 O3 |
| Smiles: | CCC1(CC2(CN(C2)C(Cn2c(C)cc(C(F)(F)F)n2)=O)OC1)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.8448 |
| logD: | 0.8448 |
| logSw: | -0.9489 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.797 |
| InChI Key: | JPDSNKLNUBEGLC-ZDUSSCGKSA-N |