3-(4-ethoxy-3-methoxyphenyl)-N-[4-(3-oxo-4-propyl-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-(3-oxo-4-propyl-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-1,3-thiazol-2-yl]prop-2-enamide
3-(4-ethoxy-3-methoxyphenyl)-N-[4-(3-oxo-4-propyl-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-1,3-thiazol-2-yl]prop-2-enamide
Compound characteristics
Compound ID: | D487-0233 |
Compound Name: | 3-(4-ethoxy-3-methoxyphenyl)-N-[4-(3-oxo-4-propyl-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-1,3-thiazol-2-yl]prop-2-enamide |
Molecular Weight: | 493.58 |
Molecular Formula: | C26 H27 N3 O5 S |
Smiles: | CCCN1C(COc2ccc(cc12)c1csc(NC(/C=C/c2ccc(c(c2)OC)OCC)=O)n1)=O |
Stereo: | ACHIRAL |
logP: | 5.0426 |
logD: | 5.0425 |
logSw: | -4.6823 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 71.812 |
InChI Key: | CUYFKTAIDMMPDM-UHFFFAOYSA-N |