3-[2-(2,4-dichloroanilino)-1,3-thiazol-4-yl]-8-ethoxy-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-[2-(2,4-dichloroanilino)-1,3-thiazol-4-yl]-8-ethoxy-2H-1-benzopyran-2-one
3-[2-(2,4-dichloroanilino)-1,3-thiazol-4-yl]-8-ethoxy-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | 1926-2307 |
| Compound Name: | 3-[2-(2,4-dichloroanilino)-1,3-thiazol-4-yl]-8-ethoxy-2H-1-benzopyran-2-one |
| Molecular Weight: | 433.31 |
| Molecular Formula: | C20 H14 Cl2 N2 O3 S |
| Smiles: | CCOc1cccc2C=C(C(=O)Oc12)c1csc(Nc2ccc(cc2[Cl])[Cl])n1 |
| Stereo: | ACHIRAL |
| logP: | 6.3899 |
| logD: | 6.3899 |
| logSw: | -6.2505 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.044 |
| InChI Key: | RGQZNCLBLFGUNX-UHFFFAOYSA-N |