N-(4-{8-tert-butyl-4-[(2-methylphenyl)imino]-2-(methylsulfanyl)-1,3-diazaspiro[4.5]dec-2-en-1-yl}phenyl)acetamide--hydrogen iodide (1/1)
Chemical Structure Depiction of
N-(4-{8-tert-butyl-4-[(2-methylphenyl)imino]-2-(methylsulfanyl)-1,3-diazaspiro[4.5]dec-2-en-1-yl}phenyl)acetamide--hydrogen iodide (1/1)
N-(4-{8-tert-butyl-4-[(2-methylphenyl)imino]-2-(methylsulfanyl)-1,3-diazaspiro[4.5]dec-2-en-1-yl}phenyl)acetamide--hydrogen iodide (1/1)
Compound characteristics
| Compound ID: | 0954-1179 |
| Compound Name: | N-(4-{8-tert-butyl-4-[(2-methylphenyl)imino]-2-(methylsulfanyl)-1,3-diazaspiro[4.5]dec-2-en-1-yl}phenyl)acetamide--hydrogen iodide (1/1) |
| Molecular Weight: | 604.6 |
| Molecular Formula: | C28 H36 N4 O S |
| Salt: | HI |
| Smiles: | CC(Nc1ccc(cc1)N1C(=NC(\C12CCC(CC2)C(C)(C)C)=N/c1ccccc1C)SC)=O |
| Stereo: | ACHIRAL |
| logP: | 6.5518 |
| logD: | 6.5518 |
| logSw: | -5.6414 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.823 |
| InChI Key: | PXYUGYIIYHVDMN-JVCXMKTPSA-N |