2-[4-cyano-3-(trifluoromethyl)phenyl]-N-methyl-8-(3-methyl-1H-pyrazole-5-carbonyl)-2,8-diazaspiro[4.5]decane-4-carboxamide
Chemical Structure Depiction of
2-[4-cyano-3-(trifluoromethyl)phenyl]-N-methyl-8-(3-methyl-1H-pyrazole-5-carbonyl)-2,8-diazaspiro[4.5]decane-4-carboxamide
2-[4-cyano-3-(trifluoromethyl)phenyl]-N-methyl-8-(3-methyl-1H-pyrazole-5-carbonyl)-2,8-diazaspiro[4.5]decane-4-carboxamide
Compound characteristics
| Compound ID: | S952-5272 |
| Compound Name: | 2-[4-cyano-3-(trifluoromethyl)phenyl]-N-methyl-8-(3-methyl-1H-pyrazole-5-carbonyl)-2,8-diazaspiro[4.5]decane-4-carboxamide |
| Molecular Weight: | 474.48 |
| Molecular Formula: | C23 H25 F3 N6 O2 |
| Smiles: | Cc1cc(C(N2CCC3(CC2)CN(CC3C(NC)=O)c2ccc(C#N)c(c2)C(F)(F)F)=O)[nH]n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.4256 |
| logD: | 1.4255 |
| logSw: | -2.4391 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.76 |
| InChI Key: | YBWNWRMEOFYJJC-SFHVURJKSA-N |