4-(2-{2-[3-(4-fluorophenyl)-5-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxo-4,5-dihydro-1,3-thiazol-5-yl}acetamido)benzoic acid
Chemical Structure Depiction of
4-(2-{2-[3-(4-fluorophenyl)-5-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxo-4,5-dihydro-1,3-thiazol-5-yl}acetamido)benzoic acid
4-(2-{2-[3-(4-fluorophenyl)-5-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxo-4,5-dihydro-1,3-thiazol-5-yl}acetamido)benzoic acid
Compound characteristics
| Compound ID: | C202-2449 |
| Compound Name: | 4-(2-{2-[3-(4-fluorophenyl)-5-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxo-4,5-dihydro-1,3-thiazol-5-yl}acetamido)benzoic acid |
| Molecular Weight: | 530.58 |
| Molecular Formula: | C28 H23 F N4 O4 S |
| Smiles: | Cc1ccc(cc1)C1CC(c2ccc(cc2)F)=NN1C1=NC(C(CC(Nc2ccc(cc2)C(O)=O)=O)S1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.3104 |
| logD: | 2.9151 |
| logSw: | -5.18 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.381 |
| InChI Key: | NVGAKBGLIOAFSC-UHFFFAOYSA-N |