N-benzyl-2-[2-(2-chloro-4-fluoroanilino)-2-oxoethyl]-4-methyl-1,3-thiazole-5-carboxamide
Chemical Structure Depiction of
N-benzyl-2-[2-(2-chloro-4-fluoroanilino)-2-oxoethyl]-4-methyl-1,3-thiazole-5-carboxamide
N-benzyl-2-[2-(2-chloro-4-fluoroanilino)-2-oxoethyl]-4-methyl-1,3-thiazole-5-carboxamide
Compound characteristics
| Compound ID: | P497-0886 |
| Compound Name: | N-benzyl-2-[2-(2-chloro-4-fluoroanilino)-2-oxoethyl]-4-methyl-1,3-thiazole-5-carboxamide |
| Molecular Weight: | 417.89 |
| Molecular Formula: | C20 H17 Cl F N3 O2 S |
| Smiles: | Cc1c(C(NCc2ccccc2)=O)sc(CC(Nc2ccc(cc2[Cl])F)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.8785 |
| logD: | 3.8709 |
| logSw: | -4.2354 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.909 |
| InChI Key: | WIAKOAKLIWIMMK-UHFFFAOYSA-N |