8-methoxy-3-[5-methyl-2-(3-methylanilino)-1,3-thiazol-4-yl]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
8-methoxy-3-[5-methyl-2-(3-methylanilino)-1,3-thiazol-4-yl]-2H-1-benzopyran-2-one
8-methoxy-3-[5-methyl-2-(3-methylanilino)-1,3-thiazol-4-yl]-2H-1-benzopyran-2-one
Compound characteristics
Compound ID: | K232-1900 |
Compound Name: | 8-methoxy-3-[5-methyl-2-(3-methylanilino)-1,3-thiazol-4-yl]-2H-1-benzopyran-2-one |
Molecular Weight: | 378.45 |
Molecular Formula: | C21 H18 N2 O3 S |
Smiles: | Cc1cccc(c1)Nc1nc(C2=Cc3cccc(c3OC2=O)OC)c(C)s1 |
Stereo: | ACHIRAL |
logP: | 5.2676 |
logD: | 5.2676 |
logSw: | -5.2354 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 47.932 |
InChI Key: | JIXICMZFOSHANM-UHFFFAOYSA-N |