3-ethyl-5-({3-methoxy-4-[(prop-2-yn-1-yl)oxy]phenyl}methylidene)-2-sulfanylideneimidazolidin-4-one
Chemical Structure Depiction of
3-ethyl-5-({3-methoxy-4-[(prop-2-yn-1-yl)oxy]phenyl}methylidene)-2-sulfanylideneimidazolidin-4-one
3-ethyl-5-({3-methoxy-4-[(prop-2-yn-1-yl)oxy]phenyl}methylidene)-2-sulfanylideneimidazolidin-4-one
Compound characteristics
| Compound ID: | 5371-4513 |
| Compound Name: | 3-ethyl-5-({3-methoxy-4-[(prop-2-yn-1-yl)oxy]phenyl}methylidene)-2-sulfanylideneimidazolidin-4-one |
| Molecular Weight: | 316.38 |
| Molecular Formula: | C16 H16 N2 O3 S |
| Smiles: | CCN1C(/C(=C/c2ccc(c(c2)OC)OCC#C)NC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2435 |
| logD: | 2.2421 |
| logSw: | -2.9856 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.639 |
| InChI Key: | KHBDQUZUTIPMTG-UHFFFAOYSA-N |