N-({3-ethyl-1-(4-fluorophenyl)-5-[4-(propan-2-yl)piperazin-1-yl]-1H-pyrazol-4-yl}methyl)-N-(2-methylpropyl)-N'-[3-(trifluoromethyl)phenyl]urea
Chemical Structure Depiction of
N-({3-ethyl-1-(4-fluorophenyl)-5-[4-(propan-2-yl)piperazin-1-yl]-1H-pyrazol-4-yl}methyl)-N-(2-methylpropyl)-N'-[3-(trifluoromethyl)phenyl]urea
N-({3-ethyl-1-(4-fluorophenyl)-5-[4-(propan-2-yl)piperazin-1-yl]-1H-pyrazol-4-yl}methyl)-N-(2-methylpropyl)-N'-[3-(trifluoromethyl)phenyl]urea
Compound characteristics
| Compound ID: | V014-0913 |
| Compound Name: | N-({3-ethyl-1-(4-fluorophenyl)-5-[4-(propan-2-yl)piperazin-1-yl]-1H-pyrazol-4-yl}methyl)-N-(2-methylpropyl)-N'-[3-(trifluoromethyl)phenyl]urea |
| Molecular Weight: | 588.69 |
| Molecular Formula: | C31 H40 F4 N6 O |
| Salt: | not_available |
| Smiles: | CCc1c(CN(CC(C)C)C(Nc2cccc(c2)C(F)(F)F)=O)c(N2CCN(CC2)C(C)C)n(c2ccc(cc2)F)n1 |
| Stereo: | ACHIRAL |
| logP: | 7.3421 |
| logD: | 4.9131 |
| logSw: | -5.6899 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.499 |
| InChI Key: | NMUYQZLERIIQGM-UHFFFAOYSA-N |