3-(4-ethoxy-3-methoxyphenyl)-N-[4-(4-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-1,3-thiazol-2-yl]prop-2-enamide
Chemical Structure Depiction of
3-(4-ethoxy-3-methoxyphenyl)-N-[4-(4-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-1,3-thiazol-2-yl]prop-2-enamide
3-(4-ethoxy-3-methoxyphenyl)-N-[4-(4-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-1,3-thiazol-2-yl]prop-2-enamide
Compound characteristics
Compound ID: | D487-0055 |
Compound Name: | 3-(4-ethoxy-3-methoxyphenyl)-N-[4-(4-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-1,3-thiazol-2-yl]prop-2-enamide |
Molecular Weight: | 479.55 |
Molecular Formula: | C25 H25 N3 O5 S |
Smiles: | CCN1C(COc2ccc(cc12)c1csc(NC(/C=C/c2ccc(c(c2)OC)OCC)=O)n1)=O |
Stereo: | ACHIRAL |
logP: | 4.6313 |
logD: | 4.6313 |
logSw: | -4.4382 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 71.558 |
InChI Key: | GDEXRBDPXFNZFQ-UHFFFAOYSA-N |