N'-butyl-N-({3-ethyl-1-(4-fluorophenyl)-5-[4-(propan-2-yl)piperazin-1-yl]-1H-pyrazol-4-yl}methyl)-N-(2-methylpropyl)urea
Chemical Structure Depiction of
N'-butyl-N-({3-ethyl-1-(4-fluorophenyl)-5-[4-(propan-2-yl)piperazin-1-yl]-1H-pyrazol-4-yl}methyl)-N-(2-methylpropyl)urea
N'-butyl-N-({3-ethyl-1-(4-fluorophenyl)-5-[4-(propan-2-yl)piperazin-1-yl]-1H-pyrazol-4-yl}methyl)-N-(2-methylpropyl)urea
Compound characteristics
| Compound ID: | V016-6074 |
| Compound Name: | N'-butyl-N-({3-ethyl-1-(4-fluorophenyl)-5-[4-(propan-2-yl)piperazin-1-yl]-1H-pyrazol-4-yl}methyl)-N-(2-methylpropyl)urea |
| Molecular Weight: | 500.7 |
| Molecular Formula: | C28 H45 F N6 O |
| Smiles: | CCCCNC(N(CC(C)C)Cc1c(CC)nn(c2ccc(cc2)F)c1N1CCN(CC1)C(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 6.2219 |
| logD: | 3.7929 |
| logSw: | -5.437 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.935 |
| InChI Key: | HZXOIGUHKNEGMH-UHFFFAOYSA-N |