8-[4-cyano-3-(trifluoromethyl)phenyl]-N-cyclopropyl-2-[(1-methyl-1H-pyrrol-2-yl)methyl]-2,8-diazaspiro[4.5]decane-4-carboxamide
Chemical Structure Depiction of
8-[4-cyano-3-(trifluoromethyl)phenyl]-N-cyclopropyl-2-[(1-methyl-1H-pyrrol-2-yl)methyl]-2,8-diazaspiro[4.5]decane-4-carboxamide
8-[4-cyano-3-(trifluoromethyl)phenyl]-N-cyclopropyl-2-[(1-methyl-1H-pyrrol-2-yl)methyl]-2,8-diazaspiro[4.5]decane-4-carboxamide
Compound characteristics
| Compound ID: | S952-0356 |
| Compound Name: | 8-[4-cyano-3-(trifluoromethyl)phenyl]-N-cyclopropyl-2-[(1-methyl-1H-pyrrol-2-yl)methyl]-2,8-diazaspiro[4.5]decane-4-carboxamide |
| Molecular Weight: | 485.55 |
| Molecular Formula: | C26 H30 F3 N5 O |
| Smiles: | Cn1cccc1CN1CC(C(NC2CC2)=O)C2(CCN(CC2)c2ccc(C#N)c(c2)C(F)(F)F)C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0132 |
| logD: | 0.8134 |
| logSw: | -3.4524 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.808 |
| InChI Key: | XZJMYYCTXQIKDT-HSZRJFAPSA-N |