2-[4-cyano-3-(trifluoromethyl)phenyl]-N,N-dimethyl-8-(pyrimidine-2-carbonyl)-2,8-diazaspiro[4.5]decane-3-carboxamide
Chemical Structure Depiction of
2-[4-cyano-3-(trifluoromethyl)phenyl]-N,N-dimethyl-8-(pyrimidine-2-carbonyl)-2,8-diazaspiro[4.5]decane-3-carboxamide
2-[4-cyano-3-(trifluoromethyl)phenyl]-N,N-dimethyl-8-(pyrimidine-2-carbonyl)-2,8-diazaspiro[4.5]decane-3-carboxamide
Compound characteristics
| Compound ID: | S953-5580 |
| Compound Name: | 2-[4-cyano-3-(trifluoromethyl)phenyl]-N,N-dimethyl-8-(pyrimidine-2-carbonyl)-2,8-diazaspiro[4.5]decane-3-carboxamide |
| Molecular Weight: | 486.5 |
| Molecular Formula: | C24 H25 F3 N6 O2 |
| Smiles: | CN(C)C(C1CC2(CCN(CC2)C(c2ncccn2)=O)CN1c1ccc(C#N)c(c1)C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.6133 |
| logD: | 0.6133 |
| logSw: | -2.0666 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 72.553 |
| InChI Key: | IJVFNVJJOJWESP-IBGZPJMESA-N |