3-(2-chloro-6-fluorophenyl)-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-5-methyl-1,2-oxazole-4-carboxamide
Chemical Structure Depiction of
3-(2-chloro-6-fluorophenyl)-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-5-methyl-1,2-oxazole-4-carboxamide
3-(2-chloro-6-fluorophenyl)-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-5-methyl-1,2-oxazole-4-carboxamide
Compound characteristics
| Compound ID: | K061-1080 |
| Compound Name: | 3-(2-chloro-6-fluorophenyl)-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-5-methyl-1,2-oxazole-4-carboxamide |
| Molecular Weight: | 440.86 |
| Molecular Formula: | C22 H18 Cl F N4 O3 |
| Smiles: | CC1=C(C(N(c2ccccc2)N1C)=O)NC(c1c(c2c(cccc2[Cl])F)noc1C)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3651 |
| logD: | 0.749 |
| logSw: | -3.4957 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.671 |
| InChI Key: | PYENIUGWBSWLIM-UHFFFAOYSA-N |