N'-tert-butyl-N-{[5-(4-fluorophenoxy)-1-methyl-3-phenyl-1H-pyrazol-4-yl]methyl}-N-[(oxolan-2-yl)methyl]urea
Chemical Structure Depiction of
N'-tert-butyl-N-{[5-(4-fluorophenoxy)-1-methyl-3-phenyl-1H-pyrazol-4-yl]methyl}-N-[(oxolan-2-yl)methyl]urea
N'-tert-butyl-N-{[5-(4-fluorophenoxy)-1-methyl-3-phenyl-1H-pyrazol-4-yl]methyl}-N-[(oxolan-2-yl)methyl]urea
Compound characteristics
| Compound ID: | V004-0944 |
| Compound Name: | N'-tert-butyl-N-{[5-(4-fluorophenoxy)-1-methyl-3-phenyl-1H-pyrazol-4-yl]methyl}-N-[(oxolan-2-yl)methyl]urea |
| Molecular Weight: | 480.58 |
| Molecular Formula: | C27 H33 F N4 O3 |
| Salt: | not_available |
| Smiles: | CC(C)(C)NC(N(CC1CCCO1)Cc1c(c2ccccc2)nn(C)c1Oc1ccc(cc1)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5324 |
| logD: | 4.5323 |
| logSw: | -4.2407 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.096 |
| InChI Key: | XDWPPAJCOUSSSW-UHFFFAOYSA-N |