N'-ethyl-N-{[3-ethyl-1-(4-fluorophenyl)-5-phenoxy-1H-pyrazol-4-yl]methyl}-N-[(oxolan-2-yl)methyl]urea
Chemical Structure Depiction of
N'-ethyl-N-{[3-ethyl-1-(4-fluorophenyl)-5-phenoxy-1H-pyrazol-4-yl]methyl}-N-[(oxolan-2-yl)methyl]urea
N'-ethyl-N-{[3-ethyl-1-(4-fluorophenyl)-5-phenoxy-1H-pyrazol-4-yl]methyl}-N-[(oxolan-2-yl)methyl]urea
Compound characteristics
Compound ID: | V025-9789 |
Compound Name: | N'-ethyl-N-{[3-ethyl-1-(4-fluorophenyl)-5-phenoxy-1H-pyrazol-4-yl]methyl}-N-[(oxolan-2-yl)methyl]urea |
Molecular Weight: | 466.56 |
Molecular Formula: | C26 H31 F N4 O3 |
Salt: | not_available |
Smiles: | CCc1c(CN(CC2CCCO2)C(NCC)=O)c(n(c2ccc(cc2)F)n1)Oc1ccccc1 |
Stereo: | RACEMIC MIXTURE |
logP: | 4.5097 |
logD: | 4.5097 |
logSw: | -4.2768 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 56.243 |
InChI Key: | IUDQTDIJOOUYLM-JOCHJYFZSA-N |