ethyl 4-(2-{2-[5-(4-ethylphenyl)-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl]-4-oxo-4,5-dihydro-1,3-thiazol-5-yl}acetamido)benzoate
Chemical Structure Depiction of
ethyl 4-(2-{2-[5-(4-ethylphenyl)-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl]-4-oxo-4,5-dihydro-1,3-thiazol-5-yl}acetamido)benzoate
ethyl 4-(2-{2-[5-(4-ethylphenyl)-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl]-4-oxo-4,5-dihydro-1,3-thiazol-5-yl}acetamido)benzoate
Compound characteristics
| Compound ID: | C202-2815 |
| Compound Name: | ethyl 4-(2-{2-[5-(4-ethylphenyl)-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl]-4-oxo-4,5-dihydro-1,3-thiazol-5-yl}acetamido)benzoate |
| Molecular Weight: | 554.67 |
| Molecular Formula: | C31 H30 N4 O4 S |
| Smiles: | CCc1ccc(cc1)C1CC(c2ccccc2)=NN1C1=NC(C(CC(Nc2ccc(cc2)C(=O)OCC)=O)S1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.4367 |
| logD: | 6.4363 |
| logSw: | -5.8599 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.726 |
| InChI Key: | RXLTZJWIMYHFFZ-UHFFFAOYSA-N |