ethyl [4-(2,5-dimethylphenyl)-2-[(4-fluorophenyl)imino]-1,3-thiazol-3(2H)-yl]acetate--hydrogen bromide (1/1)
Chemical Structure Depiction of
ethyl [4-(2,5-dimethylphenyl)-2-[(4-fluorophenyl)imino]-1,3-thiazol-3(2H)-yl]acetate--hydrogen bromide (1/1)
ethyl [4-(2,5-dimethylphenyl)-2-[(4-fluorophenyl)imino]-1,3-thiazol-3(2H)-yl]acetate--hydrogen bromide (1/1)
Compound characteristics
Compound ID: | 8009-0501 |
Compound Name: | ethyl [4-(2,5-dimethylphenyl)-2-[(4-fluorophenyl)imino]-1,3-thiazol-3(2H)-yl]acetate--hydrogen bromide (1/1) |
Molecular Weight: | 465.38 |
Molecular Formula: | C21 H21 F N2 O2 S |
Salt: | HBr |
Smiles: | CCOC(CN1C(=CSC/1=N/c1ccc(cc1)F)c1cc(C)ccc1C)=O |
Stereo: | ACHIRAL |
logP: | 5.353 |
logD: | 5.3527 |
logSw: | -5.21 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 31.733 |
InChI Key: | LLWOESLKEFQFDO-LNVKXUELSA-N |