N-{[3-ethyl-5-(4-fluorophenoxy)-1-phenyl-1H-pyrazol-4-yl]methyl}-N-[(oxolan-2-yl)methyl]-N'-(propan-2-yl)urea
Chemical Structure Depiction of
N-{[3-ethyl-5-(4-fluorophenoxy)-1-phenyl-1H-pyrazol-4-yl]methyl}-N-[(oxolan-2-yl)methyl]-N'-(propan-2-yl)urea
N-{[3-ethyl-5-(4-fluorophenoxy)-1-phenyl-1H-pyrazol-4-yl]methyl}-N-[(oxolan-2-yl)methyl]-N'-(propan-2-yl)urea
Compound characteristics
Compound ID: | V001-7597 |
Compound Name: | N-{[3-ethyl-5-(4-fluorophenoxy)-1-phenyl-1H-pyrazol-4-yl]methyl}-N-[(oxolan-2-yl)methyl]-N'-(propan-2-yl)urea |
Molecular Weight: | 480.58 |
Molecular Formula: | C27 H33 F N4 O3 |
Salt: | not_available |
Smiles: | CCc1c(CN(CC2CCCO2)C(NC(C)C)=O)c(n(c2ccccc2)n1)Oc1ccc(cc1)F |
Stereo: | RACEMIC MIXTURE |
logP: | 5.0086 |
logD: | 5.0086 |
logSw: | -4.4787 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 55.591 |
InChI Key: | FVWNEQRJYQJJJD-HSZRJFAPSA-N |