5-[(5-bromo-3-ethoxy-2-hydroxyphenyl)methylidene]-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-4-one
Chemical Structure Depiction of
5-[(5-bromo-3-ethoxy-2-hydroxyphenyl)methylidene]-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-4-one
5-[(5-bromo-3-ethoxy-2-hydroxyphenyl)methylidene]-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-4-one
Compound characteristics
Compound ID: | 3229-0226 |
Compound Name: | 5-[(5-bromo-3-ethoxy-2-hydroxyphenyl)methylidene]-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-4-one |
Molecular Weight: | 400.31 |
Molecular Formula: | C15 H14 Br N O3 S2 |
Smiles: | CCOc1cc(cc(\C=C2/C(N(CC=C)C(=S)S2)=O)c1O)[Br] |
Stereo: | ACHIRAL |
logP: | 4.4505 |
logD: | 4.4055 |
logSw: | -4.1312 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 39.382 |
InChI Key: | RUDVVULQDWCHMG-UHFFFAOYSA-N |