2-(methylsulfanyl)-1-phenyl-N-[3-(trifluoromethyl)phenyl]-1,3-diazaspiro[4.5]dec-2-en-4-imine--hydrogen iodide (1/1)
Chemical Structure Depiction of
2-(methylsulfanyl)-1-phenyl-N-[3-(trifluoromethyl)phenyl]-1,3-diazaspiro[4.5]dec-2-en-4-imine--hydrogen iodide (1/1)
2-(methylsulfanyl)-1-phenyl-N-[3-(trifluoromethyl)phenyl]-1,3-diazaspiro[4.5]dec-2-en-4-imine--hydrogen iodide (1/1)
Compound characteristics
| Compound ID: | 8018-8005 |
| Compound Name: | 2-(methylsulfanyl)-1-phenyl-N-[3-(trifluoromethyl)phenyl]-1,3-diazaspiro[4.5]dec-2-en-4-imine--hydrogen iodide (1/1) |
| Molecular Weight: | 545.41 |
| Molecular Formula: | C22 H22 F3 N3 S |
| Salt: | HI |
| Smiles: | CSC1=NC(\C2(CCCCC2)N1c1ccccc1)=N/c1cccc(c1)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 6.1083 |
| logD: | 6.1083 |
| logSw: | -5.7679 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 20.2588 |
| InChI Key: | XUESKPYOFCQVCF-XHPQRKPJSA-N |