N'-cyclohexyl-N-{[5-(4-ethylpiperazin-1-yl)-1-(3-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]methyl}-N-(2-methylpropyl)urea
Chemical Structure Depiction of
N'-cyclohexyl-N-{[5-(4-ethylpiperazin-1-yl)-1-(3-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]methyl}-N-(2-methylpropyl)urea
N'-cyclohexyl-N-{[5-(4-ethylpiperazin-1-yl)-1-(3-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]methyl}-N-(2-methylpropyl)urea
Compound characteristics
| Compound ID: | V025-6771 |
| Compound Name: | N'-cyclohexyl-N-{[5-(4-ethylpiperazin-1-yl)-1-(3-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]methyl}-N-(2-methylpropyl)urea |
| Molecular Weight: | 498.69 |
| Molecular Formula: | C28 H43 F N6 O |
| Salt: | not_available |
| Smiles: | CCN1CCN(CC1)c1c(CN(CC(C)C)C(NC2CCCCC2)=O)c(C)nn1c1cccc(c1)F |
| Stereo: | ACHIRAL |
| logP: | 5.5812 |
| logD: | 3.5125 |
| logSw: | -5.2833 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.531 |
| InChI Key: | BUTFVLYAGRNSFU-UHFFFAOYSA-N |