3-[4-(2,5-dimethylphenyl)-1,3-thiazol-2-yl]-6-methoxy-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-[4-(2,5-dimethylphenyl)-1,3-thiazol-2-yl]-6-methoxy-2H-1-benzopyran-2-one
3-[4-(2,5-dimethylphenyl)-1,3-thiazol-2-yl]-6-methoxy-2H-1-benzopyran-2-one
Compound characteristics
Compound ID: | K277-0064 |
Compound Name: | 3-[4-(2,5-dimethylphenyl)-1,3-thiazol-2-yl]-6-methoxy-2H-1-benzopyran-2-one |
Molecular Weight: | 363.43 |
Molecular Formula: | C21 H17 N O3 S |
Smiles: | Cc1ccc(C)c(c1)c1csc(C2=Cc3cc(ccc3OC2=O)OC)n1 |
Stereo: | ACHIRAL |
logP: | 5.3339 |
logD: | 5.3339 |
logSw: | -5.409 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 38.166 |
InChI Key: | BNPBHZVSUKLNQP-UHFFFAOYSA-N |