5-({3-bromo-5-methoxy-4-[(prop-2-yn-1-yl)oxy]phenyl}methylidene)-3-ethyl-2-sulfanylideneimidazolidin-4-one
Chemical Structure Depiction of
5-({3-bromo-5-methoxy-4-[(prop-2-yn-1-yl)oxy]phenyl}methylidene)-3-ethyl-2-sulfanylideneimidazolidin-4-one
5-({3-bromo-5-methoxy-4-[(prop-2-yn-1-yl)oxy]phenyl}methylidene)-3-ethyl-2-sulfanylideneimidazolidin-4-one
Compound characteristics
| Compound ID: | 5777-0208 |
| Compound Name: | 5-({3-bromo-5-methoxy-4-[(prop-2-yn-1-yl)oxy]phenyl}methylidene)-3-ethyl-2-sulfanylideneimidazolidin-4-one |
| Molecular Weight: | 395.27 |
| Molecular Formula: | C16 H15 Br N2 O3 S |
| Smiles: | CCN1C(/C(=C/c2cc(c(c(c2)[Br])OCC#C)OC)NC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1989 |
| logD: | 3.1862 |
| logSw: | -3.4494 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.726 |
| InChI Key: | RMHILDDQFGOHCU-UHFFFAOYSA-N |