methyl 2-benzamido-3,3,3-trifluoro-2-(5-methyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)propanoate
Chemical Structure Depiction of
methyl 2-benzamido-3,3,3-trifluoro-2-(5-methyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)propanoate
methyl 2-benzamido-3,3,3-trifluoro-2-(5-methyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)propanoate
Compound characteristics
| Compound ID: | 8013-5800 |
| Compound Name: | methyl 2-benzamido-3,3,3-trifluoro-2-(5-methyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)propanoate |
| Molecular Weight: | 433.39 |
| Molecular Formula: | C21 H18 F3 N3 O4 |
| Smiles: | CC1=C(C(N(c2ccccc2)N1)=O)C(C(=O)OC)(C(F)(F)F)NC(c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9987 |
| logD: | -3.0678 |
| logSw: | -3.4218 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.867 |
| InChI Key: | KKUGDVNVLMCKQX-HXUWFJFHSA-N |