2-[4-cyano-3-(trifluoromethyl)phenyl]-8-(3,5-dimethylbenzoyl)-N-methyl-2,8-diazaspiro[4.5]decane-3-carboxamide
Chemical Structure Depiction of
2-[4-cyano-3-(trifluoromethyl)phenyl]-8-(3,5-dimethylbenzoyl)-N-methyl-2,8-diazaspiro[4.5]decane-3-carboxamide
2-[4-cyano-3-(trifluoromethyl)phenyl]-8-(3,5-dimethylbenzoyl)-N-methyl-2,8-diazaspiro[4.5]decane-3-carboxamide
Compound characteristics
| Compound ID: | S953-5222 |
| Compound Name: | 2-[4-cyano-3-(trifluoromethyl)phenyl]-8-(3,5-dimethylbenzoyl)-N-methyl-2,8-diazaspiro[4.5]decane-3-carboxamide |
| Molecular Weight: | 498.55 |
| Molecular Formula: | C27 H29 F3 N4 O2 |
| Smiles: | Cc1cc(C)cc(c1)C(N1CCC2(CC1)CC(C(NC)=O)N(C2)c1ccc(C#N)c(c1)C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3572 |
| logD: | 3.3572 |
| logSw: | -3.5589 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.953 |
| InChI Key: | CDVUHUVZWJTTCW-QHCPKHFHSA-N |