N'-tert-butyl-N-{[3-ethyl-1-(4-fluorophenyl)-5-phenoxy-1H-pyrazol-4-yl]methyl}-N-(2-methoxyethyl)urea
Chemical Structure Depiction of
N'-tert-butyl-N-{[3-ethyl-1-(4-fluorophenyl)-5-phenoxy-1H-pyrazol-4-yl]methyl}-N-(2-methoxyethyl)urea
N'-tert-butyl-N-{[3-ethyl-1-(4-fluorophenyl)-5-phenoxy-1H-pyrazol-4-yl]methyl}-N-(2-methoxyethyl)urea
Compound characteristics
| Compound ID: | V005-4294 |
| Compound Name: | N'-tert-butyl-N-{[3-ethyl-1-(4-fluorophenyl)-5-phenoxy-1H-pyrazol-4-yl]methyl}-N-(2-methoxyethyl)urea |
| Molecular Weight: | 468.57 |
| Molecular Formula: | C26 H33 F N4 O3 |
| Smiles: | CCc1c(CN(CCOC)C(NC(C)(C)C)=O)c(n(c2ccc(cc2)F)n1)Oc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.3548 |
| logD: | 5.3548 |
| logSw: | -5.2664 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.379 |
| InChI Key: | MTHSITZOBYDTKB-UHFFFAOYSA-N |