N'-tert-butyl-N-{[5-(2,4-difluorophenoxy)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}-N-[(oxolan-2-yl)methyl]urea
Chemical Structure Depiction of
N'-tert-butyl-N-{[5-(2,4-difluorophenoxy)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}-N-[(oxolan-2-yl)methyl]urea
N'-tert-butyl-N-{[5-(2,4-difluorophenoxy)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}-N-[(oxolan-2-yl)methyl]urea
Compound characteristics
| Compound ID: | V015-4820 |
| Compound Name: | N'-tert-butyl-N-{[5-(2,4-difluorophenoxy)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}-N-[(oxolan-2-yl)methyl]urea |
| Molecular Weight: | 498.57 |
| Molecular Formula: | C27 H32 F2 N4 O3 |
| Smiles: | Cc1c(CN(CC2CCCO2)C(NC(C)(C)C)=O)c(n(c2ccccc2)n1)Oc1ccc(cc1F)F |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8227 |
| logD: | 4.8227 |
| logSw: | -4.7161 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.839 |
| InChI Key: | OXNRDLFHYYLDEB-OAQYLSRUSA-N |