2-[4-cyano-3-(trifluoromethyl)phenyl]-N-methyl-8-(oxane-4-carbonyl)-2,8-diazaspiro[4.5]decane-4-carboxamide
Chemical Structure Depiction of
2-[4-cyano-3-(trifluoromethyl)phenyl]-N-methyl-8-(oxane-4-carbonyl)-2,8-diazaspiro[4.5]decane-4-carboxamide
2-[4-cyano-3-(trifluoromethyl)phenyl]-N-methyl-8-(oxane-4-carbonyl)-2,8-diazaspiro[4.5]decane-4-carboxamide
Compound characteristics
| Compound ID: | S952-5220 |
| Compound Name: | 2-[4-cyano-3-(trifluoromethyl)phenyl]-N-methyl-8-(oxane-4-carbonyl)-2,8-diazaspiro[4.5]decane-4-carboxamide |
| Molecular Weight: | 478.51 |
| Molecular Formula: | C24 H29 F3 N4 O3 |
| Smiles: | CNC(C1CN(CC12CCN(CC2)C(C1CCOCC1)=O)c1ccc(C#N)c(c1)C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.5855 |
| logD: | 1.5855 |
| logSw: | -2.4862 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.293 |
| InChI Key: | YJXNIHTXNHFPQJ-FQEVSTJZSA-N |