2-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]-1-(4-{2-[(pyridin-4-yl)oxy]ethyl}-1-oxa-9-azaspiro[5.5]undecan-9-yl)ethan-1-one
Chemical Structure Depiction of
2-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]-1-(4-{2-[(pyridin-4-yl)oxy]ethyl}-1-oxa-9-azaspiro[5.5]undecan-9-yl)ethan-1-one
2-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]-1-(4-{2-[(pyridin-4-yl)oxy]ethyl}-1-oxa-9-azaspiro[5.5]undecan-9-yl)ethan-1-one
Compound characteristics
| Compound ID: | S726-1279 |
| Compound Name: | 2-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]-1-(4-{2-[(pyridin-4-yl)oxy]ethyl}-1-oxa-9-azaspiro[5.5]undecan-9-yl)ethan-1-one |
| Molecular Weight: | 466.5 |
| Molecular Formula: | C23 H29 F3 N4 O3 |
| Smiles: | Cc1cc(C(F)(F)F)nn1CC(N1CCC2(CC1)CC(CCOc1ccncc1)CCO2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2505 |
| logD: | 2.2503 |
| logSw: | -2.3097 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 53.736 |
| InChI Key: | MKURGCCYZXCXAL-SFHVURJKSA-N |