ethyl 4-(2-{2-[3-(4-methylphenyl)-5-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-[3-(4-methylphenyl)-5-phenyl-4,5-dihydro-1H-pyrazol-1-yl]-4-oxo-4,5-dihydro-1,3-thiazol-5-yl}acetamido)benzoate
ethyl 4-(2-{2-[3-(4-methylphenyl)-5-phenyl-4,5-dihydro-1H-pyrazol-1-yl]-4-oxo-4,5-dihydro-1,3-thiazol-5-yl}acetamido)benzoate
Compound characteristics
| Compound ID: | C202-2816 |
| Compound Name: | ethyl 4-(2-{2-[3-(4-methylphenyl)-5-phenyl-4,5-dihydro-1H-pyrazol-1-yl]-4-oxo-4,5-dihydro-1,3-thiazol-5-yl}acetamido)benzoate |
| Molecular Weight: | 540.64 |
| Molecular Formula: | C30 H28 N4 O4 S |
| Smiles: | CCOC(c1ccc(cc1)NC(CC1C(N=C(N2C(CC(c3ccc(C)cc3)=N2)c2ccccc2)S1)=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.0388 |
| logD: | 6.0384 |
| logSw: | -5.6033 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.726 |
| InChI Key: | GGTFMWKOCGVXAN-UHFFFAOYSA-N |