N-{2-[3-(4-fluorophenyl)-5-(furan-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)-N'-[4-(trifluoromethyl)phenyl]urea
Chemical Structure Depiction of
N-{2-[3-(4-fluorophenyl)-5-(furan-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)-N'-[4-(trifluoromethyl)phenyl]urea
N-{2-[3-(4-fluorophenyl)-5-(furan-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)-N'-[4-(trifluoromethyl)phenyl]urea
Compound characteristics
Compound ID: | V005-8067 |
Compound Name: | N-{2-[3-(4-fluorophenyl)-5-(furan-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)-N'-[4-(trifluoromethyl)phenyl]urea |
Molecular Weight: | 532.49 |
Molecular Formula: | C26 H24 F4 N4 O4 |
Smiles: | COCCN(CC(N1C(CC(c2ccc(cc2)F)=N1)c1ccco1)=O)C(Nc1ccc(cc1)C(F)(F)F)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.6325 |
logD: | 4.6325 |
logSw: | -4.3038 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 68.79 |
InChI Key: | PDSAIXXYZHLAJO-JOCHJYFZSA-N |