2-[4-cyano-3-(trifluoromethyl)phenyl]-8-(1H-pyrazole-4-carbonyl)-2,8-diazaspiro[4.5]decane-4-carboxamide
Chemical Structure Depiction of
2-[4-cyano-3-(trifluoromethyl)phenyl]-8-(1H-pyrazole-4-carbonyl)-2,8-diazaspiro[4.5]decane-4-carboxamide
2-[4-cyano-3-(trifluoromethyl)phenyl]-8-(1H-pyrazole-4-carbonyl)-2,8-diazaspiro[4.5]decane-4-carboxamide
Compound characteristics
| Compound ID: | S952-5078 |
| Compound Name: | 2-[4-cyano-3-(trifluoromethyl)phenyl]-8-(1H-pyrazole-4-carbonyl)-2,8-diazaspiro[4.5]decane-4-carboxamide |
| Molecular Weight: | 446.43 |
| Molecular Formula: | C21 H21 F3 N6 O2 |
| Smiles: | C1CN(CCC12CN(CC2C(N)=O)c1ccc(C#N)c(c1)C(F)(F)F)C(c1cn[nH]c1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.5651 |
| logD: | 0.5651 |
| logSw: | -2.2307 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 96.036 |
| InChI Key: | HJWNTQWQJUXZJO-KRWDZBQOSA-N |