4-oxo-2-(propylsulfanyl)-3-azaspiro[5.5]undec-1-ene-1,5-dicarbonitrile
Chemical Structure Depiction of
4-oxo-2-(propylsulfanyl)-3-azaspiro[5.5]undec-1-ene-1,5-dicarbonitrile
4-oxo-2-(propylsulfanyl)-3-azaspiro[5.5]undec-1-ene-1,5-dicarbonitrile
Compound characteristics
| Compound ID: | 8001-3552 |
| Compound Name: | 4-oxo-2-(propylsulfanyl)-3-azaspiro[5.5]undec-1-ene-1,5-dicarbonitrile |
| Molecular Weight: | 289.4 |
| Molecular Formula: | C15 H19 N3 O S |
| Smiles: | CCCSC1=C(C#N)C2(CCCCC2)C(C#N)C(N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4437 |
| logD: | 2.4211 |
| logSw: | -2.7457 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.492 |
| InChI Key: | ABNQOSOLNPDKTK-NSHDSACASA-N |