8-[4-cyano-3-(trifluoromethyl)phenyl]-2-(1-ethyl-1H-pyrazole-4-carbonyl)-2,8-diazaspiro[4.5]decane-3-carboxamide
Chemical Structure Depiction of
8-[4-cyano-3-(trifluoromethyl)phenyl]-2-(1-ethyl-1H-pyrazole-4-carbonyl)-2,8-diazaspiro[4.5]decane-3-carboxamide
8-[4-cyano-3-(trifluoromethyl)phenyl]-2-(1-ethyl-1H-pyrazole-4-carbonyl)-2,8-diazaspiro[4.5]decane-3-carboxamide
Compound characteristics
| Compound ID: | S953-0156 |
| Compound Name: | 8-[4-cyano-3-(trifluoromethyl)phenyl]-2-(1-ethyl-1H-pyrazole-4-carbonyl)-2,8-diazaspiro[4.5]decane-3-carboxamide |
| Molecular Weight: | 474.48 |
| Molecular Formula: | C23 H25 F3 N6 O2 |
| Smiles: | CCn1cc(cn1)C(N1CC2(CCN(CC2)c2ccc(C#N)c(c2)C(F)(F)F)CC1C(N)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.3051 |
| logD: | 1.3051 |
| logSw: | -2.3373 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.678 |
| InChI Key: | VXBBNTBRPGBMDC-LJQANCHMSA-N |