N-{4-[2-(3-chloro-4-fluoroanilino)-2-oxoethyl]-1,3-thiazol-2-yl}-3,5-dimethoxybenzamide
Chemical Structure Depiction of
N-{4-[2-(3-chloro-4-fluoroanilino)-2-oxoethyl]-1,3-thiazol-2-yl}-3,5-dimethoxybenzamide
N-{4-[2-(3-chloro-4-fluoroanilino)-2-oxoethyl]-1,3-thiazol-2-yl}-3,5-dimethoxybenzamide
Compound characteristics
| Compound ID: | F186-0713 |
| Compound Name: | N-{4-[2-(3-chloro-4-fluoroanilino)-2-oxoethyl]-1,3-thiazol-2-yl}-3,5-dimethoxybenzamide |
| Molecular Weight: | 449.89 |
| Molecular Formula: | C20 H17 Cl F N3 O4 S |
| Smiles: | COc1cc(cc(c1)OC)C(Nc1nc(CC(Nc2ccc(c(c2)[Cl])F)=O)cs1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7353 |
| logD: | 4.7205 |
| logSw: | -4.886 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.837 |
| InChI Key: | HBYIJGHFUWDUGR-UHFFFAOYSA-N |