3-[2-(3,4-dimethoxyanilino)-1,3-thiazol-4-yl]-8-methoxy-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-[2-(3,4-dimethoxyanilino)-1,3-thiazol-4-yl]-8-methoxy-2H-1-benzopyran-2-one
3-[2-(3,4-dimethoxyanilino)-1,3-thiazol-4-yl]-8-methoxy-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | K232-0199 |
| Compound Name: | 3-[2-(3,4-dimethoxyanilino)-1,3-thiazol-4-yl]-8-methoxy-2H-1-benzopyran-2-one |
| Molecular Weight: | 410.45 |
| Molecular Formula: | C21 H18 N2 O5 S |
| Smiles: | COc1ccc(cc1OC)Nc1nc(cs1)C1=Cc2cccc(c2OC1=O)OC |
| Stereo: | ACHIRAL |
| logP: | 4.2061 |
| logD: | 4.2061 |
| logSw: | -4.59 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.423 |
| InChI Key: | KZXPLGYSXBNZJE-UHFFFAOYSA-N |