6-chloro-3-[2-(2,5-dimethoxyanilino)-1,3-thiazol-4-yl]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-chloro-3-[2-(2,5-dimethoxyanilino)-1,3-thiazol-4-yl]-2H-1-benzopyran-2-one
6-chloro-3-[2-(2,5-dimethoxyanilino)-1,3-thiazol-4-yl]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | K232-0435 |
| Compound Name: | 6-chloro-3-[2-(2,5-dimethoxyanilino)-1,3-thiazol-4-yl]-2H-1-benzopyran-2-one |
| Molecular Weight: | 414.87 |
| Molecular Formula: | C20 H15 Cl N2 O4 S |
| Smiles: | COc1ccc(c(c1)Nc1nc(cs1)C1=Cc2cc(ccc2OC1=O)[Cl])OC |
| Stereo: | ACHIRAL |
| logP: | 5.2771 |
| logD: | 5.2771 |
| logSw: | -5.9047 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.324 |
| InChI Key: | NJRVAGJBGVANAJ-UHFFFAOYSA-N |