5-({3-methoxy-4-[(prop-2-yn-1-yl)oxy]phenyl}methylidene)-3-methyl-2-sulfanylideneimidazolidin-4-one
Chemical Structure Depiction of
5-({3-methoxy-4-[(prop-2-yn-1-yl)oxy]phenyl}methylidene)-3-methyl-2-sulfanylideneimidazolidin-4-one
5-({3-methoxy-4-[(prop-2-yn-1-yl)oxy]phenyl}methylidene)-3-methyl-2-sulfanylideneimidazolidin-4-one
Compound characteristics
| Compound ID: | 5371-4088 |
| Compound Name: | 5-({3-methoxy-4-[(prop-2-yn-1-yl)oxy]phenyl}methylidene)-3-methyl-2-sulfanylideneimidazolidin-4-one |
| Molecular Weight: | 302.35 |
| Molecular Formula: | C15 H14 N2 O3 S |
| Smiles: | CN1C(/C(=C/c2ccc(c(c2)OC)OCC#C)NC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7057 |
| logD: | 1.7014 |
| logSw: | -2.5348 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.68 |
| InChI Key: | XITHXWYUVVDDGM-UHFFFAOYSA-N |