3-[2-(3,4-dimethoxyanilino)-1,3-thiazol-4-yl]-6-methoxy-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-[2-(3,4-dimethoxyanilino)-1,3-thiazol-4-yl]-6-methoxy-2H-1-benzopyran-2-one
3-[2-(3,4-dimethoxyanilino)-1,3-thiazol-4-yl]-6-methoxy-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | K232-0357 |
| Compound Name: | 3-[2-(3,4-dimethoxyanilino)-1,3-thiazol-4-yl]-6-methoxy-2H-1-benzopyran-2-one |
| Molecular Weight: | 410.45 |
| Molecular Formula: | C21 H18 N2 O5 S |
| Smiles: | COc1ccc2c(C=C(C(=O)O2)c2csc(Nc3ccc(c(c3)OC)OC)n2)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.2619 |
| logD: | 4.2619 |
| logSw: | -4.5254 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.652 |
| InChI Key: | NASYIAZJAIJZFK-UHFFFAOYSA-N |