N'-{[1,1,1,3,3,3-hexafluoro-2-(5-methyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)propan-2-yl]oxy}benzenecarboximidamide
Chemical Structure Depiction of
N'-{[1,1,1,3,3,3-hexafluoro-2-(5-methyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)propan-2-yl]oxy}benzenecarboximidamide
N'-{[1,1,1,3,3,3-hexafluoro-2-(5-methyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)propan-2-yl]oxy}benzenecarboximidamide
Compound characteristics
| Compound ID: | 5256-4733 |
| Compound Name: | N'-{[1,1,1,3,3,3-hexafluoro-2-(5-methyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)propan-2-yl]oxy}benzenecarboximidamide |
| Molecular Weight: | 458.36 |
| Molecular Formula: | C20 H16 F6 N4 O2 |
| Smiles: | CC1=C(C(N(c2ccccc2)N1)=O)C(C(F)(F)F)(C(F)(F)F)O/N=C(\c1ccccc1)N |
| Stereo: | ACHIRAL |
| logP: | 3.7393 |
| logD: | 3.6542 |
| logSw: | -4.0833 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 66.303 |
| InChI Key: | IROBTXJDMWJKSN-UHFFFAOYSA-N |