8-[4-cyano-3-(trifluoromethyl)phenyl]-2-(ethanesulfonyl)-N,N-dimethyl-2,8-diazaspiro[4.5]decane-4-carboxamide
Chemical Structure Depiction of
8-[4-cyano-3-(trifluoromethyl)phenyl]-2-(ethanesulfonyl)-N,N-dimethyl-2,8-diazaspiro[4.5]decane-4-carboxamide
8-[4-cyano-3-(trifluoromethyl)phenyl]-2-(ethanesulfonyl)-N,N-dimethyl-2,8-diazaspiro[4.5]decane-4-carboxamide
Compound characteristics
| Compound ID: | S952-0518 |
| Compound Name: | 8-[4-cyano-3-(trifluoromethyl)phenyl]-2-(ethanesulfonyl)-N,N-dimethyl-2,8-diazaspiro[4.5]decane-4-carboxamide |
| Molecular Weight: | 472.53 |
| Molecular Formula: | C21 H27 F3 N4 O3 S |
| Smiles: | CCS(N1CC(C(N(C)C)=O)C2(CCN(CC2)c2ccc(C#N)c(c2)C(F)(F)F)C1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.2454 |
| logD: | 1.2454 |
| logSw: | -2.5388 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 68.586 |
| InChI Key: | KTYBTFAGZZESMO-SFHVURJKSA-N |