1-{8-[4-(cyclopropylmethyl)-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-(cyclopropylmethyl)-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-(cyclopropylmethyl)-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: | SD74-0612 |
| Compound Name: | 1-{8-[4-(cyclopropylmethyl)-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: | 422.45 |
| Molecular Formula: | C20 H25 F3 N6 O |
| Smiles: | Cc1cc(C(F)(F)F)nn1CC(N1CC(c2nncn2CC2CC2)C2(CCC2)C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.4018 |
| logD: | 1.4017 |
| logSw: | -1.4452 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 55.652 |
| InChI Key: | CRJHXPYMRFCLCW-HNNXBMFYSA-N |