3-[5-ethyl-4-(4-methylphenyl)-1,3-thiazol-2-yl]-7-hydroxy-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-[5-ethyl-4-(4-methylphenyl)-1,3-thiazol-2-yl]-7-hydroxy-2H-1-benzopyran-2-one
3-[5-ethyl-4-(4-methylphenyl)-1,3-thiazol-2-yl]-7-hydroxy-2H-1-benzopyran-2-one
Compound characteristics
Compound ID: | K277-0138 |
Compound Name: | 3-[5-ethyl-4-(4-methylphenyl)-1,3-thiazol-2-yl]-7-hydroxy-2H-1-benzopyran-2-one |
Molecular Weight: | 363.43 |
Molecular Formula: | C21 H17 N O3 S |
Smiles: | CCc1c(c2ccc(C)cc2)nc(C2=Cc3ccc(cc3OC2=O)O)s1 |
Stereo: | ACHIRAL |
logP: | 5.3578 |
logD: | 5.285 |
logSw: | -5.1982 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 49.01 |
InChI Key: | QRJVELDMZISQMF-UHFFFAOYSA-N |