1-[2-(2-chloro-4-fluoroanilino)-4-methyl-1,3-thiazol-5-yl]ethan-1-one--hydrogen chloride (1/1)
Chemical Structure Depiction of
1-[2-(2-chloro-4-fluoroanilino)-4-methyl-1,3-thiazol-5-yl]ethan-1-one--hydrogen chloride (1/1)
1-[2-(2-chloro-4-fluoroanilino)-4-methyl-1,3-thiazol-5-yl]ethan-1-one--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | Y507-4301 |
| Compound Name: | 1-[2-(2-chloro-4-fluoroanilino)-4-methyl-1,3-thiazol-5-yl]ethan-1-one--hydrogen chloride (1/1) |
| Molecular Weight: | 321.2 |
| Molecular Formula: | C12 H10 Cl F N2 O S |
| Salt: | HCl |
| Smiles: | CC(c1c(C)nc(Nc2ccc(cc2[Cl])F)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9826 |
| logD: | 3.9826 |
| logSw: | -4.244 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 32.903 |
| InChI Key: | BEQMXTYWIUTXJY-UHFFFAOYSA-N |