N'-cyclohexyl-N-{[5-(4-ethylpiperazin-1-yl)-1-(3-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]methyl}-N-propylurea
Chemical Structure Depiction of
N'-cyclohexyl-N-{[5-(4-ethylpiperazin-1-yl)-1-(3-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]methyl}-N-propylurea
N'-cyclohexyl-N-{[5-(4-ethylpiperazin-1-yl)-1-(3-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]methyl}-N-propylurea
Compound characteristics
| Compound ID: | V025-3835 |
| Compound Name: | N'-cyclohexyl-N-{[5-(4-ethylpiperazin-1-yl)-1-(3-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]methyl}-N-propylurea |
| Molecular Weight: | 484.66 |
| Molecular Formula: | C27 H41 F N6 O |
| Salt: | not_available |
| Smiles: | CCCN(Cc1c(C)nn(c2cccc(c2)F)c1N1CCN(CC)CC1)C(NC1CCCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.123 |
| logD: | 3.0543 |
| logSw: | -5.0344 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.509 |
| InChI Key: | JCNTYUCJCRADRW-UHFFFAOYSA-N |