6-bromo-3-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-bromo-3-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]-2H-1-benzopyran-2-one
6-bromo-3-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]-2H-1-benzopyran-2-one
Compound characteristics
Compound ID: | 1246-0825 |
Compound Name: | 6-bromo-3-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]-2H-1-benzopyran-2-one |
Molecular Weight: | 428.3 |
Molecular Formula: | C20 H14 Br N O3 S |
Smiles: | CCOc1ccc(cc1)c1csc(C2=Cc3cc(ccc3OC2=O)[Br])n1 |
Stereo: | ACHIRAL |
logP: | 5.893 |
logD: | 5.893 |
logSw: | -5.5425 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 37.746 |
InChI Key: | ICERQQFTBLETRC-UHFFFAOYSA-N |