8-[4-cyano-3-(trifluoromethyl)phenyl]-2-(2,4-dimethylbenzoyl)-N-methyl-2,8-diazaspiro[4.5]decane-3-carboxamide
Chemical Structure Depiction of
8-[4-cyano-3-(trifluoromethyl)phenyl]-2-(2,4-dimethylbenzoyl)-N-methyl-2,8-diazaspiro[4.5]decane-3-carboxamide
8-[4-cyano-3-(trifluoromethyl)phenyl]-2-(2,4-dimethylbenzoyl)-N-methyl-2,8-diazaspiro[4.5]decane-3-carboxamide
Compound characteristics
| Compound ID: | S953-0216 |
| Compound Name: | 8-[4-cyano-3-(trifluoromethyl)phenyl]-2-(2,4-dimethylbenzoyl)-N-methyl-2,8-diazaspiro[4.5]decane-3-carboxamide |
| Molecular Weight: | 498.55 |
| Molecular Formula: | C27 H29 F3 N4 O2 |
| Smiles: | Cc1ccc(C(N2CC3(CCN(CC3)c3ccc(C#N)c(c3)C(F)(F)F)CC2C(NC)=O)=O)c(C)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7168 |
| logD: | 3.7168 |
| logSw: | -3.8999 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.953 |
| InChI Key: | LDDAVHYCYFBJBK-HSZRJFAPSA-N |