2-[(1,5-dicyano-4-oxo-3-azaspiro[5.5]undec-1-en-2-yl)sulfanyl]-N-(4-fluorophenyl)acetamide
Chemical Structure Depiction of
2-[(1,5-dicyano-4-oxo-3-azaspiro[5.5]undec-1-en-2-yl)sulfanyl]-N-(4-fluorophenyl)acetamide
2-[(1,5-dicyano-4-oxo-3-azaspiro[5.5]undec-1-en-2-yl)sulfanyl]-N-(4-fluorophenyl)acetamide
Compound characteristics
| Compound ID: | 4552-4081 |
| Compound Name: | 2-[(1,5-dicyano-4-oxo-3-azaspiro[5.5]undec-1-en-2-yl)sulfanyl]-N-(4-fluorophenyl)acetamide |
| Molecular Weight: | 398.46 |
| Molecular Formula: | C20 H19 F N4 O2 S |
| Smiles: | C1CCC2(CC1)C(C#N)C(NC(=C2C#N)SCC(Nc1ccc(cc1)F)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5926 |
| logD: | 2.5707 |
| logSw: | -3.0516 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.37 |
| InChI Key: | SKEHIMZZANDMHP-HNNXBMFYSA-N |