3-cyclohexyl-5-({3-ethoxy-4-[(prop-2-yn-1-yl)oxy]phenyl}methylidene)-1-methyl-2-sulfanylideneimidazolidin-4-one
Chemical Structure Depiction of
3-cyclohexyl-5-({3-ethoxy-4-[(prop-2-yn-1-yl)oxy]phenyl}methylidene)-1-methyl-2-sulfanylideneimidazolidin-4-one
3-cyclohexyl-5-({3-ethoxy-4-[(prop-2-yn-1-yl)oxy]phenyl}methylidene)-1-methyl-2-sulfanylideneimidazolidin-4-one
Compound characteristics
| Compound ID: | 5792-6659 |
| Compound Name: | 3-cyclohexyl-5-({3-ethoxy-4-[(prop-2-yn-1-yl)oxy]phenyl}methylidene)-1-methyl-2-sulfanylideneimidazolidin-4-one |
| Molecular Weight: | 398.52 |
| Molecular Formula: | C22 H26 N2 O3 S |
| Smiles: | CCOc1cc(/C=C2/C(N(C3CCCCC3)C(N2C)=S)=O)ccc1OCC#C |
| Stereo: | ACHIRAL |
| logP: | 3.5174 |
| logD: | 3.5174 |
| logSw: | -3.7502 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 31.849 |
| InChI Key: | DXILWRCEQZAGSL-UHFFFAOYSA-N |