methyl 2-benzamido-3,3,3-trifluoro-N-(3-methyl-1-phenyl-1H-pyrazol-5-yl)alaninate
Chemical Structure Depiction of
methyl 2-benzamido-3,3,3-trifluoro-N-(3-methyl-1-phenyl-1H-pyrazol-5-yl)alaninate
methyl 2-benzamido-3,3,3-trifluoro-N-(3-methyl-1-phenyl-1H-pyrazol-5-yl)alaninate
Compound characteristics
| Compound ID: | 8013-5789 |
| Compound Name: | methyl 2-benzamido-3,3,3-trifluoro-N-(3-methyl-1-phenyl-1H-pyrazol-5-yl)alaninate |
| Molecular Weight: | 432.4 |
| Molecular Formula: | C21 H19 F3 N4 O3 |
| Smiles: | Cc1cc(NC(C(=O)OC)(C(F)(F)F)NC(c2ccccc2)=O)n(c2ccccc2)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5082 |
| logD: | 2.5134 |
| logSw: | -3.7402 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.942 |
| InChI Key: | RTAITQCOZNULGK-FQEVSTJZSA-N |