2-{2-[5-(4-chlorophenyl)-3-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxo-4,5-dihydro-1,3-thiazol-5-yl}-N-(3,4-difluorophenyl)acetamide
Chemical Structure Depiction of
2-{2-[5-(4-chlorophenyl)-3-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxo-4,5-dihydro-1,3-thiazol-5-yl}-N-(3,4-difluorophenyl)acetamide
2-{2-[5-(4-chlorophenyl)-3-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxo-4,5-dihydro-1,3-thiazol-5-yl}-N-(3,4-difluorophenyl)acetamide
Compound characteristics
Compound ID: | E239-0756 |
Compound Name: | 2-{2-[5-(4-chlorophenyl)-3-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxo-4,5-dihydro-1,3-thiazol-5-yl}-N-(3,4-difluorophenyl)acetamide |
Molecular Weight: | 539 |
Molecular Formula: | C27 H21 Cl F2 N4 O2 S |
Smiles: | Cc1ccc(cc1)C1CC(c2ccc(cc2)[Cl])N(C2=NC(C(CC(Nc3ccc(c(c3)F)F)=O)S2)=O)N=1 |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 6.3844 |
logD: | 6.3517 |
logSw: | -6.4444 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 58.972 |
InChI Key: | COEUBSGLPNJJLL-UHFFFAOYSA-N |